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Enter Data
| Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kJ/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Pituitary adenylate cyclase-activating polypeptide (RAT) | BDBM82448 ([Ala2]PACAP(1-27)) Show SMILES CCC(C)[C@H](NC(=O)CNC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(N)=O |r,wU:48.49,63.64,81.83,98.100,121.124,139.142,152.155,168.171,189.193,202.207,214.218,49.52,4.4,12.17,26.26,wD:37.37,55.56,69.70,87.89,110.113,147.151,177.180,197.202,207.211,130.133,159.162,21.21,(-14.46,-50.6,;-14.44,-52.33,;-15.67,-53.24,;-17,-52.47,;-15.67,-54.78,;-17,-55.55,;-18.34,-54.78,;-18.34,-53.24,;-19.43,-55.87,;-20.76,-55.1,;-22.14,-55.94,;-22.14,-57.48,;-23.47,-55.17,;-23.47,-53.63,;-24.56,-52.54,;-24.56,-51,;-25.89,-50.23,;-23.23,-50.23,;-24.56,-56.25,;-25.89,-55.48,;-25.96,-54.17,;-27.23,-56.25,;-27.23,-57.79,;-28.56,-55.48,;-29.89,-56.25,;-29.89,-57.79,;-31.23,-55.48,;-32.54,-56.66,;-31.23,-53.94,;-32,-52.61,;-32,-51.07,;-34.67,-51.07,;-34.67,-52.61,;-33.33,-53.38,;-14.34,-55.55,;-14.41,-57.12,;-13,-54.78,;-11.67,-55.55,;-11.67,-57.09,;-10.34,-57.86,;-9,-57.09,;-7.66,-57.86,;-7.66,-59.41,;-9,-60.18,;-10.34,-59.41,;-10.34,-54.78,;-10.34,-53.24,;-9,-55.55,;-7.67,-54.78,;-7.67,-53.24,;-9,-52.47,;-6.33,-52.47,;-6.33,-55.55,;-6.33,-57.09,;-5,-54.78,;-3.67,-55.55,;-3.67,-57.09,;-2.33,-57.86,;-1,-57.09,;-2.33,-59.4,;-2.33,-54.78,;-2.33,-53.24,;-1,-55.55,;.33,-54.78,;.33,-53.24,;1.67,-52.47,;1.67,-55.55,;1.67,-57.09,;3,-54.78,;4.34,-55.55,;4.34,-57.09,;5.67,-57.86,;7.01,-57.09,;8.35,-57.86,;8.35,-59.41,;9.68,-60.18,;7.01,-60.18,;5.67,-59.41,;5.67,-54.78,;5.67,-53.24,;7,-55.55,;8.34,-54.78,;8.34,-53.24,;9.67,-52.47,;9.67,-55.55,;9.67,-57.09,;11,-54.78,;12.34,-55.55,;12.34,-57.09,;13.67,-57.86,;13.67,-59.4,;15,-60.17,;15,-61.71,;13.67,-62.48,;16.34,-62.48,;13.67,-54.78,;13.67,-53.24,;15,-55.55,;16.34,-54.78,;16.34,-53.24,;17.67,-52.47,;19.01,-53.25,;20.35,-52.47,;20.35,-50.93,;21.68,-50.16,;19.01,-50.16,;17.67,-50.93,;17.67,-55.55,;17.67,-57.09,;19.01,-54.78,;20.34,-55.55,;20.34,-57.09,;21.67,-57.86,;21.67,-59.4,;23.01,-60.17,;23.01,-61.71,;21.67,-62.48,;24.34,-62.48,;21.67,-54.78,;21.67,-53.24,;23.01,-55.55,;24.34,-54.78,;24.34,-53.24,;25.67,-52.47,;25.67,-50.93,;27.01,-50.16,;27.01,-48.62,;25.67,-55.55,;25.67,-57.09,;27.01,-54.78,;28.34,-55.55,;28.34,-57.09,;29.67,-57.86,;29.67,-59.4,;28.34,-60.17,;31.01,-60.17,;29.67,-54.78,;29.67,-53.24,;31.01,-55.55,;32.34,-54.78,;32.34,-53.24,;33.68,-52.47,;33.68,-50.93,;35.01,-50.16,;33.68,-55.55,;33.68,-57.09,;35.01,-54.78,;36.34,-55.55,;36.34,-57.09,;37.68,-54.78,;37.68,-53.24,;39.01,-55.55,;40.34,-54.78,;40.34,-53.24,;41.68,-52.47,;39.01,-52.47,;41.68,-55.55,;41.68,-57.09,;43.01,-54.78,;44.34,-55.55,;44.34,-57.09,;45.68,-57.86,;45.68,-59.4,;47.01,-60.17,;47.01,-61.71,;45.68,-54.78,;45.68,-53.24,;47.01,-55.55,;48.35,-54.78,;48.35,-53.24,;49.68,-52.47,;49.68,-50.93,;51.01,-50.16,;51.01,-48.62,;49.68,-55.55,;49.68,-57.09,;51.01,-54.78,;52.35,-55.55,;52.35,-57.09,;53.68,-57.86,;55.02,-57.09,;56.36,-57.86,;56.36,-59.41,;57.69,-60.18,;55.02,-60.18,;53.68,-59.41,;53.68,-54.78,;53.68,-53.24,;55.01,-55.55,;56.35,-54.78,;56.35,-53.24,;57.68,-52.47,;57.68,-50.93,;59.01,-53.24,;57.68,-55.55,;57.68,-57.09,;59.01,-54.78,;60.35,-55.55,;60.35,-57.09,;61.68,-54.78,;61.68,-53.24,;63.02,-55.55,;64.35,-54.78,;64.35,-53.24,;65.68,-55.55,;65.68,-57.09,;67.02,-54.78,;68.35,-55.55,;68.35,-57.09,;69.68,-57.86,;67.02,-57.86,;69.68,-54.78,;69.68,-53.24,;71.02,-55.55,;72.35,-54.78,;72.35,-53.24,;73.68,-52.47,;73.68,-50.93,;75.02,-53.24,;73.68,-55.55,;75.02,-54.78,;73.68,-57.09,)| Show InChI InChI=1S/C143H226N40O38S/c1-17-76(10)114(180-109(191)68-157-122(202)96(49-51-110(192)193)163-118(198)78(12)160-121(201)90(147)65-86-67-154-71-158-86)140(220)176-104(61-82-29-19-18-20-30-82)135(215)183-115(81(15)186)141(221)177-105(66-111(194)195)134(214)179-107(70-185)137(217)175-103(64-85-40-46-89(189)47-41-85)133(213)178-106(69-184)136(216)167-95(35-28-57-156-143(152)153)128(208)173-101(62-83-36-42-87(187)43-37-83)131(211)166-94(34-27-56-155-142(150)151)126(206)164-91(31-21-24-53-144)124(204)168-97(48-50-108(148)190)129(209)169-98(52-58-222-16)123(203)161-80(14)120(200)181-112(74(6)7)138(218)170-93(33-23-26-55-146)125(205)165-92(32-22-25-54-145)127(207)174-102(63-84-38-44-88(188)45-39-84)132(212)172-100(60-73(4)5)130(210)162-77(11)117(197)159-79(13)119(199)182-113(75(8)9)139(219)171-99(116(149)196)59-72(2)3/h18-20,29-30,36-47,67,71-81,90-107,112-115,184-189H,17,21-28,31-35,48-66,68-70,144-147H2,1-16H3,(H2,148,190)(H2,149,196)(H,154,158)(H,157,202)(H,159,197)(H,160,201)(H,161,203)(H,162,210)(H,163,198)(H,164,206)(H,165,205)(H,166,211)(H,167,216)(H,168,204)(H,169,209)(H,170,218)(H,171,219)(H,172,212)(H,173,208)(H,174,207)(H,175,217)(H,176,220)(H,177,221)(H,178,213)(H,179,214)(H,180,191)(H,181,200)(H,182,199)(H,183,215)(H,192,193)(H,194,195)(H4,150,151,155)(H4,152,153,156)/t76?,77-,78-,79-,80-,81+,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,112-,113-,114-,115-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet  | PC cid PC sid UniChem Similars | Article PubMed | 0.300 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Neuropharmacology 33: 1189-95 (1994) Article DOI: 10.1016/s0028-3908(05)80009-7 BindingDB Entry DOI: 10.7270/Q2251GP3 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| VIP peptides (RAT) | BDBM50250019 (CHEMBL524658 | PACAP | PACAP(1-38) | PACAP-38 | PA...) Show SMILES CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(N)=O |r| Show InChI InChI=1S/C203H331N63O53S/c1-18-109(12)162(262-156(279)99-230-170(290)147(95-157(280)281)255-193(313)149(100-267)259-168(288)124(211)93-119-97-224-103-231-119)198(318)257-145(88-114-40-20-19-21-41-114)191(311)266-163(113(16)270)199(319)258-148(96-158(282)283)190(310)261-151(102-269)194(314)253-144(92-118-59-67-123(274)68-60-118)188(308)260-150(101-268)192(312)243-134(51-38-83-227-202(220)221)180(300)251-142(90-116-55-63-121(272)64-56-116)186(306)242-132(49-36-81-225-200(216)217)176(296)237-127(44-24-31-76-206)173(293)245-137(70-72-153(213)276)182(302)246-138(73-85-320-17)171(291)233-112(15)167(287)263-159(106(6)7)195(315)247-130(47-27-34-79-209)175(295)238-129(46-26-33-78-208)177(297)252-143(91-117-57-65-122(273)66-58-117)187(307)249-140(87-105(4)5)184(304)234-110(13)165(285)232-111(14)166(286)264-160(107(8)9)197(317)256-139(86-104(2)3)169(289)229-98-155(278)235-126(43-23-30-75-205)172(292)239-133(50-37-82-226-201(218)219)179(299)250-141(89-115-53-61-120(271)62-54-115)185(305)241-128(45-25-32-77-207)174(294)244-136(69-71-152(212)275)181(301)240-135(52-39-84-228-203(222)223)183(303)265-161(108(10)11)196(316)248-131(48-28-35-80-210)178(298)254-146(94-154(214)277)189(309)236-125(164(215)284)42-22-29-74-204/h19-21,40-41,53-68,97,103-113,124-151,159-163,267-274H,18,22-39,42-52,69-96,98-102,204-211H2,1-17H3,(H2,212,275)(H2,213,276)(H2,214,277)(H2,215,284)(H,224,231)(H,229,289)(H,230,290)(H,232,285)(H,233,291)(H,234,304)(H,235,278)(H,236,309)(H,237,296)(H,238,295)(H,239,292)(H,240,301)(H,241,305)(H,242,306)(H,243,312)(H,244,294)(H,245,293)(H,246,302)(H,247,315)(H,248,316)(H,249,307)(H,250,299)(H,251,300)(H,252,297)(H,253,314)(H,254,298)(H,255,313)(H,256,317)(H,257,318)(H,258,319)(H,259,288)(H,260,308)(H,261,310)(H,262,279)(H,263,287)(H,264,286)(H,265,303)(H,266,311)(H,280,281)(H,282,283)(H4,216,217,225)(H4,218,219,226)(H4,220,221,227)(H4,222,223,228)/t109-,110-,111-,112-,113+,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,142-,143-,144-,145-,146-,147-,148-,149-,150-,151-,159-,160-,161-,162-,163-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 0.300 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 195: 535-41 (1991) Article DOI: 10.1111/j.1432-1033.1991.tb15734.x BindingDB Entry DOI: 10.7270/Q2RV0M66 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (RAT) | BDBM50250019 (CHEMBL524658 | PACAP | PACAP(1-38) | PACAP-38 | PA...) Show SMILES CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(N)=O |r| Show InChI InChI=1S/C203H331N63O53S/c1-18-109(12)162(262-156(279)99-230-170(290)147(95-157(280)281)255-193(313)149(100-267)259-168(288)124(211)93-119-97-224-103-231-119)198(318)257-145(88-114-40-20-19-21-41-114)191(311)266-163(113(16)270)199(319)258-148(96-158(282)283)190(310)261-151(102-269)194(314)253-144(92-118-59-67-123(274)68-60-118)188(308)260-150(101-268)192(312)243-134(51-38-83-227-202(220)221)180(300)251-142(90-116-55-63-121(272)64-56-116)186(306)242-132(49-36-81-225-200(216)217)176(296)237-127(44-24-31-76-206)173(293)245-137(70-72-153(213)276)182(302)246-138(73-85-320-17)171(291)233-112(15)167(287)263-159(106(6)7)195(315)247-130(47-27-34-79-209)175(295)238-129(46-26-33-78-208)177(297)252-143(91-117-57-65-122(273)66-58-117)187(307)249-140(87-105(4)5)184(304)234-110(13)165(285)232-111(14)166(286)264-160(107(8)9)197(317)256-139(86-104(2)3)169(289)229-98-155(278)235-126(43-23-30-75-205)172(292)239-133(50-37-82-226-201(218)219)179(299)250-141(89-115-53-61-120(271)62-54-115)185(305)241-128(45-25-32-77-207)174(294)244-136(69-71-152(212)275)181(301)240-135(52-39-84-228-203(222)223)183(303)265-161(108(10)11)196(316)248-131(48-28-35-80-210)178(298)254-146(94-154(214)277)189(309)236-125(164(215)284)42-22-29-74-204/h19-21,40-41,53-68,97,103-113,124-151,159-163,267-274H,18,22-39,42-52,69-96,98-102,204-211H2,1-17H3,(H2,212,275)(H2,213,276)(H2,214,277)(H2,215,284)(H,224,231)(H,229,289)(H,230,290)(H,232,285)(H,233,291)(H,234,304)(H,235,278)(H,236,309)(H,237,296)(H,238,295)(H,239,292)(H,240,301)(H,241,305)(H,242,306)(H,243,312)(H,244,294)(H,245,293)(H,246,302)(H,247,315)(H,248,316)(H,249,307)(H,250,299)(H,251,300)(H,252,297)(H,253,314)(H,254,298)(H,255,313)(H,256,317)(H,257,318)(H,258,319)(H,259,288)(H,260,308)(H,261,310)(H,262,279)(H,263,287)(H,264,286)(H,265,303)(H,266,311)(H,280,281)(H,282,283)(H4,216,217,225)(H4,218,219,226)(H4,220,221,227)(H4,222,223,228)/t109-,110-,111-,112-,113+,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,142-,143-,144-,145-,146-,147-,148-,149-,150-,151-,159-,160-,161-,162-,163-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 0.300 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Neuropharmacology 33: 1189-95 (1994) Article DOI: 10.1016/s0028-3908(05)80009-7 BindingDB Entry DOI: 10.7270/Q2251GP3 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| VIP peptides (Homo sapiens (Human)) | BDBM50250068 (CHEMBL501240 | PACAP(1-27) | PACAP-27 | [Glu3]PACA...) Show SMILES CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(N)=O |r,wU:27.27,12.17,4.4,49.50,50.53,64.65,82.84,99.101,122.125,140.143,153.156,169.172,190.194,203.208,215.219,wD:21.23,2.2,38.38,56.57,70.71,88.90,111.114,131.134,148.152,160.163,178.181,198.203,208.212,(4.62,.39,;4.62,-1.15,;5.96,-1.91,;7.29,-1.15,;5.96,-3.45,;4.62,-4.22,;3.28,-3.45,;3.28,-1.91,;1.95,-4.22,;.62,-3.45,;-.71,-4.22,;-.71,-5.76,;-2.04,-3.45,;-2.04,-1.91,;-.71,-1.15,;-.71,.39,;-2.04,1.16,;.62,1.16,;-3.38,-4.22,;-4.72,-3.45,;-4.72,-1.91,;-6.05,-4.22,;-6.05,-5.76,;-4.72,-6.54,;-7.38,-3.45,;-8.71,-4.22,;-8.71,-5.76,;-10.04,-3.45,;-11.38,-4.22,;-10.04,-1.91,;-8.71,-1.15,;-7.3,-1.78,;-6.27,-.62,;-7.04,.71,;-8.55,.39,;7.29,-4.22,;7.29,-5.76,;8.62,-3.45,;9.95,-4.22,;9.95,-5.76,;11.28,-6.54,;12.63,-5.76,;13.96,-6.54,;13.96,-8.08,;12.63,-8.85,;11.28,-8.08,;11.28,-3.45,;11.28,-1.91,;12.62,-4.22,;13.95,-3.45,;13.95,-1.91,;12.62,-1.15,;15.29,-1.15,;15.29,-4.22,;15.29,-5.76,;16.62,-3.45,;17.95,-4.22,;17.95,-5.76,;19.28,-6.54,;20.61,-5.76,;19.28,-8.07,;19.28,-3.45,;19.28,-1.91,;20.61,-4.22,;21.95,-3.45,;21.95,-1.91,;23.29,-1.15,;23.29,-4.22,;23.29,-5.76,;24.62,-3.45,;25.95,-4.22,;25.95,-5.76,;27.28,-6.54,;28.62,-5.76,;29.96,-6.54,;29.96,-8.08,;31.29,-8.85,;28.62,-8.85,;27.28,-8.08,;27.28,-3.45,;27.28,-1.91,;28.61,-4.22,;29.95,-3.45,;29.95,-1.91,;31.29,-1.15,;31.29,-4.22,;31.29,-5.76,;32.62,-3.45,;33.95,-4.22,;33.95,-5.76,;35.28,-6.54,;35.28,-8.07,;36.61,-8.85,;36.61,-10.39,;35.28,-11.15,;37.94,-11.15,;35.28,-3.45,;35.28,-1.91,;36.61,-4.22,;37.94,-3.45,;37.94,-1.91,;39.29,-1.15,;40.62,-1.91,;41.96,-1.15,;41.96,.39,;43.29,1.17,;40.62,1.17,;39.29,.39,;39.29,-4.22,;39.29,-5.76,;40.62,-3.45,;41.95,-4.22,;41.95,-5.76,;43.28,-6.54,;43.28,-8.07,;44.61,-8.85,;44.61,-10.39,;43.28,-11.15,;45.94,-11.15,;43.28,-3.45,;43.28,-1.91,;44.61,-4.22,;45.94,-3.45,;45.94,-1.91,;47.28,-1.15,;47.28,.39,;48.62,1.16,;48.62,2.7,;47.28,-4.22,;47.28,-5.76,;48.62,-3.45,;49.95,-4.22,;49.95,-5.76,;51.28,-6.54,;51.28,-8.07,;49.95,-8.85,;52.61,-8.85,;51.28,-3.45,;51.28,-1.91,;52.61,-4.22,;53.94,-3.45,;53.94,-1.91,;55.28,-1.15,;55.28,.39,;56.62,1.16,;55.28,-4.22,;55.28,-5.76,;56.62,-3.45,;57.95,-4.22,;57.95,-5.76,;59.28,-3.45,;59.28,-1.91,;60.61,-4.22,;61.94,-3.45,;61.94,-1.91,;63.27,-1.15,;60.61,-1.15,;63.27,-4.22,;63.27,-5.76,;64.61,-3.45,;65.95,-4.22,;65.95,-5.76,;67.28,-6.54,;67.28,-8.07,;68.61,-8.85,;68.61,-10.39,;67.28,-3.45,;67.28,-1.91,;68.61,-4.22,;69.94,-3.45,;69.94,-1.91,;71.27,-1.15,;71.27,.39,;72.61,1.16,;72.61,2.7,;71.27,-4.22,;71.27,-5.76,;72.61,-3.45,;73.95,-4.22,;73.95,-5.76,;75.28,-6.54,;76.61,-5.76,;77.95,-6.54,;77.95,-8.08,;79.28,-8.85,;76.61,-8.85,;75.28,-8.08,;75.28,-3.45,;75.28,-1.91,;76.61,-4.22,;77.94,-3.45,;77.94,-1.91,;79.27,-1.15,;79.27,.39,;80.61,-1.91,;79.27,-4.22,;79.27,-5.76,;80.61,-3.45,;81.95,-4.22,;81.95,-5.76,;83.28,-3.45,;83.28,-1.91,;84.61,-4.22,;85.94,-3.45,;85.94,-1.91,;87.27,-4.22,;87.27,-5.76,;88.61,-3.45,;89.95,-4.22,;89.95,-5.76,;91.28,-6.54,;88.61,-6.54,;91.28,-3.45,;91.28,-1.91,;92.61,-4.22,;93.94,-3.45,;93.94,-1.91,;95.27,-1.15,;95.27,.39,;96.6,-1.91,;95.27,-4.22,;96.6,-3.45,;95.27,-5.76,)| Show InChI InChI=1S/C143H226N40O39S/c1-16-76(10)114(180-109(192)67-157-121(202)95(48-50-110(193)194)166-135(216)105(68-184)177-120(201)89(147)64-85-66-154-71-158-85)140(221)175-103(60-81-28-18-17-19-29-81)134(215)183-115(80(14)187)141(222)176-104(65-111(195)196)133(214)179-107(70-186)137(218)174-102(63-84-39-45-88(190)46-40-84)132(213)178-106(69-185)136(217)165-94(34-27-56-156-143(152)153)127(208)172-100(61-82-35-41-86(188)42-36-82)130(211)164-93(33-26-55-155-142(150)151)125(206)162-90(30-20-23-52-144)123(204)167-96(47-49-108(148)191)128(209)168-97(51-57-223-15)122(203)160-79(13)119(200)181-112(74(6)7)138(219)169-92(32-22-25-54-146)124(205)163-91(31-21-24-53-145)126(207)173-101(62-83-37-43-87(189)44-38-83)131(212)171-99(59-73(4)5)129(210)161-77(11)117(198)159-78(12)118(199)182-113(75(8)9)139(220)170-98(116(149)197)58-72(2)3/h17-19,28-29,35-46,66,71-80,89-107,112-115,184-190H,16,20-27,30-34,47-65,67-70,144-147H2,1-15H3,(H2,148,191)(H2,149,197)(H,154,158)(H,157,202)(H,159,198)(H,160,203)(H,161,210)(H,162,206)(H,163,205)(H,164,211)(H,165,217)(H,166,216)(H,167,204)(H,168,209)(H,169,219)(H,170,220)(H,171,212)(H,172,208)(H,173,207)(H,174,218)(H,175,221)(H,176,222)(H,177,201)(H,178,213)(H,179,214)(H,180,192)(H,181,200)(H,182,199)(H,183,215)(H,193,194)(H,195,196)(H4,150,151,155)(H4,152,153,156)/t76-,77-,78-,79-,80+,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,112-,113-,114-,115-/m0/s1 | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 0.300 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 195: 535-41 (1991) Article DOI: 10.1111/j.1432-1033.1991.tb15734.x BindingDB Entry DOI: 10.7270/Q2RV0M66 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (RAT) | BDBM50250023 (CHEMBL500280 | [Ala2]PACAP(1-38) | [Ala2]PACAP38) Show SMILES CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(N)=O |r| Show InChI InChI=1S/C203H331N63O52S/c1-19-109(12)162(262-156(278)100-230-171(290)148(96-157(279)280)250-166(285)111(14)233-169(288)125(211)94-120-98-224-103-231-120)198(317)258-146(89-115-41-21-20-22-42-115)192(311)266-163(114(17)269)199(318)259-149(97-158(281)282)191(310)261-151(102-268)194(313)255-145(93-119-60-68-124(273)69-61-119)189(308)260-150(101-267)193(312)244-135(52-39-84-227-202(220)221)181(300)253-143(91-117-56-64-122(271)65-57-117)187(306)243-133(50-37-82-225-200(216)217)177(296)238-128(45-25-32-77-206)174(293)246-138(71-73-153(213)275)183(302)247-139(74-86-319-18)172(291)234-113(16)168(287)263-159(106(6)7)195(314)248-131(48-28-35-80-209)176(295)239-130(47-27-34-79-208)178(297)254-144(92-118-58-66-123(272)67-59-118)188(307)251-141(88-105(4)5)185(304)235-110(13)165(284)232-112(15)167(286)264-160(107(8)9)197(316)257-140(87-104(2)3)170(289)229-99-155(277)236-127(44-24-31-76-205)173(292)240-134(51-38-83-226-201(218)219)180(299)252-142(90-116-54-62-121(270)63-55-116)186(305)242-129(46-26-33-78-207)175(294)245-137(70-72-152(212)274)182(301)241-136(53-40-85-228-203(222)223)184(303)265-161(108(10)11)196(315)249-132(49-29-36-81-210)179(298)256-147(95-154(214)276)190(309)237-126(164(215)283)43-23-30-75-204/h20-22,41-42,54-69,98,103-114,125-151,159-163,267-273H,19,23-40,43-53,70-97,99-102,204-211H2,1-18H3,(H2,212,274)(H2,213,275)(H2,214,276)(H2,215,283)(H,224,231)(H,229,289)(H,230,290)(H,232,284)(H,233,288)(H,234,291)(H,235,304)(H,236,277)(H,237,309)(H,238,296)(H,239,295)(H,240,292)(H,241,301)(H,242,305)(H,243,306)(H,244,312)(H,245,294)(H,246,293)(H,247,302)(H,248,314)(H,249,315)(H,250,285)(H,251,307)(H,252,299)(H,253,300)(H,254,297)(H,255,313)(H,256,298)(H,257,316)(H,258,317)(H,259,318)(H,260,308)(H,261,310)(H,262,278)(H,263,287)(H,264,286)(H,265,303)(H,266,311)(H,279,280)(H,281,282)(H4,216,217,225)(H4,218,219,226)(H4,220,221,227)(H4,222,223,228)/t109-,110-,111-,112-,113-,114+,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,142-,143-,144-,145-,146-,147-,148-,149-,150-,151-,159-,160-,161-,162-,163-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 0.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Neuropharmacology 33: 1189-95 (1994) Article DOI: 10.1016/s0028-3908(05)80009-7 BindingDB Entry DOI: 10.7270/Q2251GP3 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| VIP peptides (RAT) | BDBM50250068 (CHEMBL501240 | PACAP(1-27) | PACAP-27 | [Glu3]PACA...) Show SMILES CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(N)=O |r,wU:27.27,12.17,4.4,49.50,50.53,64.65,82.84,99.101,122.125,140.143,153.156,169.172,190.194,203.208,215.219,wD:21.23,2.2,38.38,56.57,70.71,88.90,111.114,131.134,148.152,160.163,178.181,198.203,208.212,(4.62,.39,;4.62,-1.15,;5.96,-1.91,;7.29,-1.15,;5.96,-3.45,;4.62,-4.22,;3.28,-3.45,;3.28,-1.91,;1.95,-4.22,;.62,-3.45,;-.71,-4.22,;-.71,-5.76,;-2.04,-3.45,;-2.04,-1.91,;-.71,-1.15,;-.71,.39,;-2.04,1.16,;.62,1.16,;-3.38,-4.22,;-4.72,-3.45,;-4.72,-1.91,;-6.05,-4.22,;-6.05,-5.76,;-4.72,-6.54,;-7.38,-3.45,;-8.71,-4.22,;-8.71,-5.76,;-10.04,-3.45,;-11.38,-4.22,;-10.04,-1.91,;-8.71,-1.15,;-7.3,-1.78,;-6.27,-.62,;-7.04,.71,;-8.55,.39,;7.29,-4.22,;7.29,-5.76,;8.62,-3.45,;9.95,-4.22,;9.95,-5.76,;11.28,-6.54,;12.63,-5.76,;13.96,-6.54,;13.96,-8.08,;12.63,-8.85,;11.28,-8.08,;11.28,-3.45,;11.28,-1.91,;12.62,-4.22,;13.95,-3.45,;13.95,-1.91,;12.62,-1.15,;15.29,-1.15,;15.29,-4.22,;15.29,-5.76,;16.62,-3.45,;17.95,-4.22,;17.95,-5.76,;19.28,-6.54,;20.61,-5.76,;19.28,-8.07,;19.28,-3.45,;19.28,-1.91,;20.61,-4.22,;21.95,-3.45,;21.95,-1.91,;23.29,-1.15,;23.29,-4.22,;23.29,-5.76,;24.62,-3.45,;25.95,-4.22,;25.95,-5.76,;27.28,-6.54,;28.62,-5.76,;29.96,-6.54,;29.96,-8.08,;31.29,-8.85,;28.62,-8.85,;27.28,-8.08,;27.28,-3.45,;27.28,-1.91,;28.61,-4.22,;29.95,-3.45,;29.95,-1.91,;31.29,-1.15,;31.29,-4.22,;31.29,-5.76,;32.62,-3.45,;33.95,-4.22,;33.95,-5.76,;35.28,-6.54,;35.28,-8.07,;36.61,-8.85,;36.61,-10.39,;35.28,-11.15,;37.94,-11.15,;35.28,-3.45,;35.28,-1.91,;36.61,-4.22,;37.94,-3.45,;37.94,-1.91,;39.29,-1.15,;40.62,-1.91,;41.96,-1.15,;41.96,.39,;43.29,1.17,;40.62,1.17,;39.29,.39,;39.29,-4.22,;39.29,-5.76,;40.62,-3.45,;41.95,-4.22,;41.95,-5.76,;43.28,-6.54,;43.28,-8.07,;44.61,-8.85,;44.61,-10.39,;43.28,-11.15,;45.94,-11.15,;43.28,-3.45,;43.28,-1.91,;44.61,-4.22,;45.94,-3.45,;45.94,-1.91,;47.28,-1.15,;47.28,.39,;48.62,1.16,;48.62,2.7,;47.28,-4.22,;47.28,-5.76,;48.62,-3.45,;49.95,-4.22,;49.95,-5.76,;51.28,-6.54,;51.28,-8.07,;49.95,-8.85,;52.61,-8.85,;51.28,-3.45,;51.28,-1.91,;52.61,-4.22,;53.94,-3.45,;53.94,-1.91,;55.28,-1.15,;55.28,.39,;56.62,1.16,;55.28,-4.22,;55.28,-5.76,;56.62,-3.45,;57.95,-4.22,;57.95,-5.76,;59.28,-3.45,;59.28,-1.91,;60.61,-4.22,;61.94,-3.45,;61.94,-1.91,;63.27,-1.15,;60.61,-1.15,;63.27,-4.22,;63.27,-5.76,;64.61,-3.45,;65.95,-4.22,;65.95,-5.76,;67.28,-6.54,;67.28,-8.07,;68.61,-8.85,;68.61,-10.39,;67.28,-3.45,;67.28,-1.91,;68.61,-4.22,;69.94,-3.45,;69.94,-1.91,;71.27,-1.15,;71.27,.39,;72.61,1.16,;72.61,2.7,;71.27,-4.22,;71.27,-5.76,;72.61,-3.45,;73.95,-4.22,;73.95,-5.76,;75.28,-6.54,;76.61,-5.76,;77.95,-6.54,;77.95,-8.08,;79.28,-8.85,;76.61,-8.85,;75.28,-8.08,;75.28,-3.45,;75.28,-1.91,;76.61,-4.22,;77.94,-3.45,;77.94,-1.91,;79.27,-1.15,;79.27,.39,;80.61,-1.91,;79.27,-4.22,;79.27,-5.76,;80.61,-3.45,;81.95,-4.22,;81.95,-5.76,;83.28,-3.45,;83.28,-1.91,;84.61,-4.22,;85.94,-3.45,;85.94,-1.91,;87.27,-4.22,;87.27,-5.76,;88.61,-3.45,;89.95,-4.22,;89.95,-5.76,;91.28,-6.54,;88.61,-6.54,;91.28,-3.45,;91.28,-1.91,;92.61,-4.22,;93.94,-3.45,;93.94,-1.91,;95.27,-1.15,;95.27,.39,;96.6,-1.91,;95.27,-4.22,;96.6,-3.45,;95.27,-5.76,)| Show InChI InChI=1S/C143H226N40O39S/c1-16-76(10)114(180-109(192)67-157-121(202)95(48-50-110(193)194)166-135(216)105(68-184)177-120(201)89(147)64-85-66-154-71-158-85)140(221)175-103(60-81-28-18-17-19-29-81)134(215)183-115(80(14)187)141(222)176-104(65-111(195)196)133(214)179-107(70-186)137(218)174-102(63-84-39-45-88(190)46-40-84)132(213)178-106(69-185)136(217)165-94(34-27-56-156-143(152)153)127(208)172-100(61-82-35-41-86(188)42-36-82)130(211)164-93(33-26-55-155-142(150)151)125(206)162-90(30-20-23-52-144)123(204)167-96(47-49-108(148)191)128(209)168-97(51-57-223-15)122(203)160-79(13)119(200)181-112(74(6)7)138(219)169-92(32-22-25-54-146)124(205)163-91(31-21-24-53-145)126(207)173-101(62-83-37-43-87(189)44-38-83)131(212)171-99(59-73(4)5)129(210)161-77(11)117(198)159-78(12)118(199)182-113(75(8)9)139(220)170-98(116(149)197)58-72(2)3/h17-19,28-29,35-46,66,71-80,89-107,112-115,184-190H,16,20-27,30-34,47-65,67-70,144-147H2,1-15H3,(H2,148,191)(H2,149,197)(H,154,158)(H,157,202)(H,159,198)(H,160,203)(H,161,210)(H,162,206)(H,163,205)(H,164,211)(H,165,217)(H,166,216)(H,167,204)(H,168,209)(H,169,219)(H,170,220)(H,171,212)(H,172,208)(H,173,207)(H,174,218)(H,175,221)(H,176,222)(H,177,201)(H,178,213)(H,179,214)(H,180,192)(H,181,200)(H,182,199)(H,183,215)(H,193,194)(H,195,196)(H4,150,151,155)(H4,152,153,156)/t76-,77-,78-,79-,80+,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,112-,113-,114-,115-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 0.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 195: 535-41 (1991) Article DOI: 10.1111/j.1432-1033.1991.tb15734.x BindingDB Entry DOI: 10.7270/Q2RV0M66 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (RAT) | BDBM82447 ([DAla2]PACAP(1-38)) Show SMILES CCC(C)[C@H](NC(=O)CNC(=O)[C@H](CC(O)=O)NC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(N)=O |r| Show InChI InChI=1S/C203H331N63O52S/c1-19-109(12)162(262-156(278)100-230-171(290)148(96-157(279)280)250-166(285)111(14)233-169(288)125(211)94-120-98-224-103-231-120)198(317)258-146(89-115-41-21-20-22-42-115)192(311)266-163(114(17)269)199(318)259-149(97-158(281)282)191(310)261-151(102-268)194(313)255-145(93-119-60-68-124(273)69-61-119)189(308)260-150(101-267)193(312)244-135(52-39-84-227-202(220)221)181(300)253-143(91-117-56-64-122(271)65-57-117)187(306)243-133(50-37-82-225-200(216)217)177(296)238-128(45-25-32-77-206)174(293)246-138(71-73-153(213)275)183(302)247-139(74-86-319-18)172(291)234-113(16)168(287)263-159(106(6)7)195(314)248-131(48-28-35-80-209)176(295)239-130(47-27-34-79-208)178(297)254-144(92-118-58-66-123(272)67-59-118)188(307)251-141(88-105(4)5)185(304)235-110(13)165(284)232-112(15)167(286)264-160(107(8)9)197(316)257-140(87-104(2)3)170(289)229-99-155(277)236-127(44-24-31-76-205)173(292)240-134(51-38-83-226-201(218)219)180(299)252-142(90-116-54-62-121(270)63-55-116)186(305)242-129(46-26-33-78-207)175(294)245-137(70-72-152(212)274)182(301)241-136(53-40-85-228-203(222)223)184(303)265-161(108(10)11)196(315)249-132(49-29-36-81-210)179(298)256-147(95-154(214)276)190(309)237-126(164(215)283)43-23-30-75-204/h20-22,41-42,54-69,98,103-114,125-151,159-163,267-273H,19,23-40,43-53,70-97,99-102,204-211H2,1-18H3,(H2,212,274)(H2,213,275)(H2,214,276)(H2,215,283)(H,224,231)(H,229,289)(H,230,290)(H,232,284)(H,233,288)(H,234,291)(H,235,304)(H,236,277)(H,237,309)(H,238,296)(H,239,295)(H,240,292)(H,241,301)(H,242,305)(H,243,306)(H,244,312)(H,245,294)(H,246,293)(H,247,302)(H,248,314)(H,249,315)(H,250,285)(H,251,307)(H,252,299)(H,253,300)(H,254,297)(H,255,313)(H,256,298)(H,257,316)(H,258,317)(H,259,318)(H,260,308)(H,261,310)(H,262,278)(H,263,287)(H,264,286)(H,265,303)(H,266,311)(H,279,280)(H,281,282)(H4,216,217,225)(H4,218,219,226)(H4,220,221,227)(H4,222,223,228)/t109?,110-,111+,112-,113-,114+,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,142-,143-,144-,145-,146-,147-,148-,149-,150-,151-,159-,160-,161-,162-,163-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 0.700 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Neuropharmacology 33: 1189-95 (1994) Article DOI: 10.1016/s0028-3908(05)80009-7 BindingDB Entry DOI: 10.7270/Q2251GP3 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| VIP peptides (RAT) | BDBM50250019 (CHEMBL524658 | PACAP | PACAP(1-38) | PACAP-38 | PA...) Show SMILES CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(N)=O |r| Show InChI InChI=1S/C203H331N63O53S/c1-18-109(12)162(262-156(279)99-230-170(290)147(95-157(280)281)255-193(313)149(100-267)259-168(288)124(211)93-119-97-224-103-231-119)198(318)257-145(88-114-40-20-19-21-41-114)191(311)266-163(113(16)270)199(319)258-148(96-158(282)283)190(310)261-151(102-269)194(314)253-144(92-118-59-67-123(274)68-60-118)188(308)260-150(101-268)192(312)243-134(51-38-83-227-202(220)221)180(300)251-142(90-116-55-63-121(272)64-56-116)186(306)242-132(49-36-81-225-200(216)217)176(296)237-127(44-24-31-76-206)173(293)245-137(70-72-153(213)276)182(302)246-138(73-85-320-17)171(291)233-112(15)167(287)263-159(106(6)7)195(315)247-130(47-27-34-79-209)175(295)238-129(46-26-33-78-208)177(297)252-143(91-117-57-65-122(273)66-58-117)187(307)249-140(87-105(4)5)184(304)234-110(13)165(285)232-111(14)166(286)264-160(107(8)9)197(317)256-139(86-104(2)3)169(289)229-98-155(278)235-126(43-23-30-75-205)172(292)239-133(50-37-82-226-201(218)219)179(299)250-141(89-115-53-61-120(271)62-54-115)185(305)241-128(45-25-32-77-207)174(294)244-136(69-71-152(212)275)181(301)240-135(52-39-84-228-203(222)223)183(303)265-161(108(10)11)196(316)248-131(48-28-35-80-210)178(298)254-146(94-154(214)277)189(309)236-125(164(215)284)42-22-29-74-204/h19-21,40-41,53-68,97,103-113,124-151,159-163,267-274H,18,22-39,42-52,69-96,98-102,204-211H2,1-17H3,(H2,212,275)(H2,213,276)(H2,214,277)(H2,215,284)(H,224,231)(H,229,289)(H,230,290)(H,232,285)(H,233,291)(H,234,304)(H,235,278)(H,236,309)(H,237,296)(H,238,295)(H,239,292)(H,240,301)(H,241,305)(H,242,306)(H,243,312)(H,244,294)(H,245,293)(H,246,302)(H,247,315)(H,248,316)(H,249,307)(H,250,299)(H,251,300)(H,252,297)(H,253,314)(H,254,298)(H,255,313)(H,256,317)(H,257,318)(H,258,319)(H,259,288)(H,260,308)(H,261,310)(H,262,279)(H,263,287)(H,264,286)(H,265,303)(H,266,311)(H,280,281)(H,282,283)(H4,216,217,225)(H4,218,219,226)(H4,220,221,227)(H4,222,223,228)/t109-,110-,111-,112-,113+,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,142-,143-,144-,145-,146-,147-,148-,149-,150-,151-,159-,160-,161-,162-,163-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 0.900 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 195: 535-41 (1991) Article DOI: 10.1111/j.1432-1033.1991.tb15734.x BindingDB Entry DOI: 10.7270/Q2RV0M66 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| VIP peptides (RAT) | BDBM50250019 (CHEMBL524658 | PACAP | PACAP(1-38) | PACAP-38 | PA...) Show SMILES CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(N)=O |r| Show InChI InChI=1S/C203H331N63O53S/c1-18-109(12)162(262-156(279)99-230-170(290)147(95-157(280)281)255-193(313)149(100-267)259-168(288)124(211)93-119-97-224-103-231-119)198(318)257-145(88-114-40-20-19-21-41-114)191(311)266-163(113(16)270)199(319)258-148(96-158(282)283)190(310)261-151(102-269)194(314)253-144(92-118-59-67-123(274)68-60-118)188(308)260-150(101-268)192(312)243-134(51-38-83-227-202(220)221)180(300)251-142(90-116-55-63-121(272)64-56-116)186(306)242-132(49-36-81-225-200(216)217)176(296)237-127(44-24-31-76-206)173(293)245-137(70-72-153(213)276)182(302)246-138(73-85-320-17)171(291)233-112(15)167(287)263-159(106(6)7)195(315)247-130(47-27-34-79-209)175(295)238-129(46-26-33-78-208)177(297)252-143(91-117-57-65-122(273)66-58-117)187(307)249-140(87-105(4)5)184(304)234-110(13)165(285)232-111(14)166(286)264-160(107(8)9)197(317)256-139(86-104(2)3)169(289)229-98-155(278)235-126(43-23-30-75-205)172(292)239-133(50-37-82-226-201(218)219)179(299)250-141(89-115-53-61-120(271)62-54-115)185(305)241-128(45-25-32-77-207)174(294)244-136(69-71-152(212)275)181(301)240-135(52-39-84-228-203(222)223)183(303)265-161(108(10)11)196(316)248-131(48-28-35-80-210)178(298)254-146(94-154(214)277)189(309)236-125(164(215)284)42-22-29-74-204/h19-21,40-41,53-68,97,103-113,124-151,159-163,267-274H,18,22-39,42-52,69-96,98-102,204-211H2,1-17H3,(H2,212,275)(H2,213,276)(H2,214,277)(H2,215,284)(H,224,231)(H,229,289)(H,230,290)(H,232,285)(H,233,291)(H,234,304)(H,235,278)(H,236,309)(H,237,296)(H,238,295)(H,239,292)(H,240,301)(H,241,305)(H,242,306)(H,243,312)(H,244,294)(H,245,293)(H,246,302)(H,247,315)(H,248,316)(H,249,307)(H,250,299)(H,251,300)(H,252,297)(H,253,314)(H,254,298)(H,255,313)(H,256,317)(H,257,318)(H,258,319)(H,259,288)(H,260,308)(H,261,310)(H,262,279)(H,263,287)(H,264,286)(H,265,303)(H,266,311)(H,280,281)(H,282,283)(H4,216,217,225)(H4,218,219,226)(H4,220,221,227)(H4,222,223,228)/t109-,110-,111-,112-,113+,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,142-,143-,144-,145-,146-,147-,148-,149-,150-,151-,159-,160-,161-,162-,163-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 0.900 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 195: 535-41 (1991) Article DOI: 10.1111/j.1432-1033.1991.tb15734.x BindingDB Entry DOI: 10.7270/Q2RV0M66 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| VIP peptides (RAT) | BDBM50250068 (CHEMBL501240 | PACAP(1-27) | PACAP-27 | [Glu3]PACA...) Show SMILES CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(N)=O |r,wU:27.27,12.17,4.4,49.50,50.53,64.65,82.84,99.101,122.125,140.143,153.156,169.172,190.194,203.208,215.219,wD:21.23,2.2,38.38,56.57,70.71,88.90,111.114,131.134,148.152,160.163,178.181,198.203,208.212,(4.62,.39,;4.62,-1.15,;5.96,-1.91,;7.29,-1.15,;5.96,-3.45,;4.62,-4.22,;3.28,-3.45,;3.28,-1.91,;1.95,-4.22,;.62,-3.45,;-.71,-4.22,;-.71,-5.76,;-2.04,-3.45,;-2.04,-1.91,;-.71,-1.15,;-.71,.39,;-2.04,1.16,;.62,1.16,;-3.38,-4.22,;-4.72,-3.45,;-4.72,-1.91,;-6.05,-4.22,;-6.05,-5.76,;-4.72,-6.54,;-7.38,-3.45,;-8.71,-4.22,;-8.71,-5.76,;-10.04,-3.45,;-11.38,-4.22,;-10.04,-1.91,;-8.71,-1.15,;-7.3,-1.78,;-6.27,-.62,;-7.04,.71,;-8.55,.39,;7.29,-4.22,;7.29,-5.76,;8.62,-3.45,;9.95,-4.22,;9.95,-5.76,;11.28,-6.54,;12.63,-5.76,;13.96,-6.54,;13.96,-8.08,;12.63,-8.85,;11.28,-8.08,;11.28,-3.45,;11.28,-1.91,;12.62,-4.22,;13.95,-3.45,;13.95,-1.91,;12.62,-1.15,;15.29,-1.15,;15.29,-4.22,;15.29,-5.76,;16.62,-3.45,;17.95,-4.22,;17.95,-5.76,;19.28,-6.54,;20.61,-5.76,;19.28,-8.07,;19.28,-3.45,;19.28,-1.91,;20.61,-4.22,;21.95,-3.45,;21.95,-1.91,;23.29,-1.15,;23.29,-4.22,;23.29,-5.76,;24.62,-3.45,;25.95,-4.22,;25.95,-5.76,;27.28,-6.54,;28.62,-5.76,;29.96,-6.54,;29.96,-8.08,;31.29,-8.85,;28.62,-8.85,;27.28,-8.08,;27.28,-3.45,;27.28,-1.91,;28.61,-4.22,;29.95,-3.45,;29.95,-1.91,;31.29,-1.15,;31.29,-4.22,;31.29,-5.76,;32.62,-3.45,;33.95,-4.22,;33.95,-5.76,;35.28,-6.54,;35.28,-8.07,;36.61,-8.85,;36.61,-10.39,;35.28,-11.15,;37.94,-11.15,;35.28,-3.45,;35.28,-1.91,;36.61,-4.22,;37.94,-3.45,;37.94,-1.91,;39.29,-1.15,;40.62,-1.91,;41.96,-1.15,;41.96,.39,;43.29,1.17,;40.62,1.17,;39.29,.39,;39.29,-4.22,;39.29,-5.76,;40.62,-3.45,;41.95,-4.22,;41.95,-5.76,;43.28,-6.54,;43.28,-8.07,;44.61,-8.85,;44.61,-10.39,;43.28,-11.15,;45.94,-11.15,;43.28,-3.45,;43.28,-1.91,;44.61,-4.22,;45.94,-3.45,;45.94,-1.91,;47.28,-1.15,;47.28,.39,;48.62,1.16,;48.62,2.7,;47.28,-4.22,;47.28,-5.76,;48.62,-3.45,;49.95,-4.22,;49.95,-5.76,;51.28,-6.54,;51.28,-8.07,;49.95,-8.85,;52.61,-8.85,;51.28,-3.45,;51.28,-1.91,;52.61,-4.22,;53.94,-3.45,;53.94,-1.91,;55.28,-1.15,;55.28,.39,;56.62,1.16,;55.28,-4.22,;55.28,-5.76,;56.62,-3.45,;57.95,-4.22,;57.95,-5.76,;59.28,-3.45,;59.28,-1.91,;60.61,-4.22,;61.94,-3.45,;61.94,-1.91,;63.27,-1.15,;60.61,-1.15,;63.27,-4.22,;63.27,-5.76,;64.61,-3.45,;65.95,-4.22,;65.95,-5.76,;67.28,-6.54,;67.28,-8.07,;68.61,-8.85,;68.61,-10.39,;67.28,-3.45,;67.28,-1.91,;68.61,-4.22,;69.94,-3.45,;69.94,-1.91,;71.27,-1.15,;71.27,.39,;72.61,1.16,;72.61,2.7,;71.27,-4.22,;71.27,-5.76,;72.61,-3.45,;73.95,-4.22,;73.95,-5.76,;75.28,-6.54,;76.61,-5.76,;77.95,-6.54,;77.95,-8.08,;79.28,-8.85,;76.61,-8.85,;75.28,-8.08,;75.28,-3.45,;75.28,-1.91,;76.61,-4.22,;77.94,-3.45,;77.94,-1.91,;79.27,-1.15,;79.27,.39,;80.61,-1.91,;79.27,-4.22,;79.27,-5.76,;80.61,-3.45,;81.95,-4.22,;81.95,-5.76,;83.28,-3.45,;83.28,-1.91,;84.61,-4.22,;85.94,-3.45,;85.94,-1.91,;87.27,-4.22,;87.27,-5.76,;88.61,-3.45,;89.95,-4.22,;89.95,-5.76,;91.28,-6.54,;88.61,-6.54,;91.28,-3.45,;91.28,-1.91,;92.61,-4.22,;93.94,-3.45,;93.94,-1.91,;95.27,-1.15,;95.27,.39,;96.6,-1.91,;95.27,-4.22,;96.6,-3.45,;95.27,-5.76,)| Show InChI InChI=1S/C143H226N40O39S/c1-16-76(10)114(180-109(192)67-157-121(202)95(48-50-110(193)194)166-135(216)105(68-184)177-120(201)89(147)64-85-66-154-71-158-85)140(221)175-103(60-81-28-18-17-19-29-81)134(215)183-115(80(14)187)141(222)176-104(65-111(195)196)133(214)179-107(70-186)137(218)174-102(63-84-39-45-88(190)46-40-84)132(213)178-106(69-185)136(217)165-94(34-27-56-156-143(152)153)127(208)172-100(61-82-35-41-86(188)42-36-82)130(211)164-93(33-26-55-155-142(150)151)125(206)162-90(30-20-23-52-144)123(204)167-96(47-49-108(148)191)128(209)168-97(51-57-223-15)122(203)160-79(13)119(200)181-112(74(6)7)138(219)169-92(32-22-25-54-146)124(205)163-91(31-21-24-53-145)126(207)173-101(62-83-37-43-87(189)44-38-83)131(212)171-99(59-73(4)5)129(210)161-77(11)117(198)159-78(12)118(199)182-113(75(8)9)139(220)170-98(116(149)197)58-72(2)3/h17-19,28-29,35-46,66,71-80,89-107,112-115,184-190H,16,20-27,30-34,47-65,67-70,144-147H2,1-15H3,(H2,148,191)(H2,149,197)(H,154,158)(H,157,202)(H,159,198)(H,160,203)(H,161,210)(H,162,206)(H,163,205)(H,164,211)(H,165,217)(H,166,216)(H,167,204)(H,168,209)(H,169,219)(H,170,220)(H,171,212)(H,172,208)(H,173,207)(H,174,218)(H,175,221)(H,176,222)(H,177,201)(H,178,213)(H,179,214)(H,180,192)(H,181,200)(H,182,199)(H,183,215)(H,193,194)(H,195,196)(H4,150,151,155)(H4,152,153,156)/t76-,77-,78-,79-,80+,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,112-,113-,114-,115-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 1 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 195: 535-41 (1991) Article DOI: 10.1111/j.1432-1033.1991.tb15734.x BindingDB Entry DOI: 10.7270/Q2RV0M66 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (RAT) | BDBM82450 ([AcHis1]PACAP(1-27)) Show SMILES CCC(C)[C@H](NC(=O)CNC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cnc[nH]1)NC(C)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(N)=O |r,wU:52.53,67.68,85.87,102.104,125.128,143.146,156.159,172.175,193.197,206.211,218.222,53.56,4.4,12.17,27.34,wD:41.41,59.60,73.74,91.93,114.117,151.155,181.184,201.206,211.215,134.137,163.166,21.23,(-14.46,-50.6,;-14.44,-52.33,;-15.67,-53.24,;-17,-52.47,;-15.67,-54.78,;-17,-55.55,;-18.34,-54.78,;-18.34,-53.24,;-19.43,-55.87,;-20.76,-55.1,;-22.14,-55.94,;-22.14,-57.48,;-23.47,-55.17,;-23.47,-53.63,;-24.56,-52.54,;-24.56,-51,;-25.89,-50.23,;-23.23,-50.23,;-24.56,-56.25,;-25.89,-55.48,;-25.96,-54.17,;-27.23,-56.25,;-27.23,-57.79,;-25.89,-58.56,;-28.56,-55.48,;-29.89,-56.25,;-29.89,-57.79,;-31.23,-55.48,;-31.23,-53.94,;-32,-52.61,;-32,-51.07,;-34.67,-51.07,;-34.67,-52.61,;-33.33,-53.38,;-32.54,-56.66,;-34.03,-56.26,;-34.8,-54.92,;-35.12,-57.35,;-14.34,-55.55,;-14.41,-57.12,;-13,-54.78,;-11.67,-55.55,;-11.67,-57.09,;-10.34,-57.86,;-9,-57.09,;-7.66,-57.86,;-7.66,-59.41,;-9,-60.18,;-10.34,-59.41,;-10.34,-54.78,;-10.34,-53.24,;-9,-55.55,;-7.67,-54.78,;-7.67,-53.24,;-9,-52.47,;-6.33,-52.47,;-6.33,-55.55,;-6.33,-57.09,;-5,-54.78,;-3.67,-55.55,;-3.67,-57.09,;-2.33,-57.86,;-1,-57.09,;-2.33,-59.4,;-2.33,-54.78,;-2.33,-53.24,;-1,-55.55,;.33,-54.78,;.33,-53.24,;1.67,-52.47,;1.67,-55.55,;1.67,-57.09,;3,-54.78,;4.34,-55.55,;4.34,-57.09,;5.67,-57.86,;7.01,-57.09,;8.35,-57.86,;8.35,-59.41,;9.68,-60.18,;7.01,-60.18,;5.67,-59.41,;5.67,-54.78,;5.67,-53.24,;7,-55.55,;8.34,-54.78,;8.34,-53.24,;9.67,-52.47,;9.67,-55.55,;9.67,-57.09,;11,-54.78,;12.34,-55.55,;12.34,-57.09,;13.67,-57.86,;13.67,-59.4,;15,-60.17,;15,-61.71,;13.67,-62.48,;16.34,-62.48,;13.67,-54.78,;13.67,-53.24,;15,-55.55,;16.34,-54.78,;16.34,-53.24,;17.67,-52.47,;19.01,-53.25,;20.35,-52.47,;20.35,-50.93,;21.68,-50.16,;19.01,-50.16,;17.67,-50.93,;17.67,-55.55,;17.67,-57.09,;19.01,-54.78,;20.34,-55.55,;20.34,-57.09,;21.67,-57.86,;21.67,-59.4,;23.01,-60.17,;23.01,-61.71,;21.67,-62.48,;24.34,-62.48,;21.67,-54.78,;21.67,-53.24,;23.01,-55.55,;24.34,-54.78,;24.34,-53.24,;25.67,-52.47,;25.67,-50.93,;27.01,-50.16,;27.01,-48.62,;25.67,-55.55,;25.67,-57.09,;27.01,-54.78,;28.34,-55.55,;28.34,-57.09,;29.67,-57.86,;29.67,-59.4,;28.34,-60.17,;31.01,-60.17,;29.67,-54.78,;29.67,-53.24,;31.01,-55.55,;32.34,-54.78,;32.34,-53.24,;33.68,-52.47,;33.68,-50.93,;35.01,-50.16,;33.68,-55.55,;33.68,-57.09,;35.01,-54.78,;36.34,-55.55,;36.34,-57.09,;37.68,-54.78,;37.68,-53.24,;39.01,-55.55,;40.34,-54.78,;40.34,-53.24,;41.68,-52.47,;39.01,-52.47,;41.68,-55.55,;41.68,-57.09,;43.01,-54.78,;44.34,-55.55,;44.34,-57.09,;45.68,-57.86,;45.68,-59.4,;47.01,-60.17,;47.01,-61.71,;45.68,-54.78,;45.68,-53.24,;47.01,-55.55,;48.35,-54.78,;48.35,-53.24,;49.68,-52.47,;49.68,-50.93,;51.01,-50.16,;51.01,-48.62,;49.68,-55.55,;49.68,-57.09,;51.01,-54.78,;52.35,-55.55,;52.35,-57.09,;53.68,-57.86,;55.02,-57.09,;56.36,-57.86,;56.36,-59.41,;57.69,-60.18,;55.02,-60.18,;53.68,-59.41,;53.68,-54.78,;53.68,-53.24,;55.01,-55.55,;56.35,-54.78,;56.35,-53.24,;57.68,-52.47,;57.68,-50.93,;59.01,-53.24,;57.68,-55.55,;57.68,-57.09,;59.01,-54.78,;60.35,-55.55,;60.35,-57.09,;61.68,-54.78,;61.68,-53.24,;63.02,-55.55,;64.35,-54.78,;64.35,-53.24,;65.68,-55.55,;65.68,-57.09,;67.02,-54.78,;68.35,-55.55,;68.35,-57.09,;69.68,-57.86,;67.02,-57.86,;69.68,-54.78,;69.68,-53.24,;71.02,-55.55,;72.35,-54.78,;72.35,-53.24,;73.68,-52.47,;73.68,-50.93,;75.02,-53.24,;73.68,-55.55,;75.02,-54.78,;73.68,-57.09,)| Show InChI InChI=1S/C145H228N40O40S/c1-17-77(10)116(182-111(195)68-158-122(204)96(49-51-112(196)197)168-138(220)108(70-187)180-134(216)105(163-82(15)190)65-87-67-155-72-159-87)142(224)177-104(61-83-29-19-18-20-30-83)136(218)185-117(81(14)189)143(225)178-106(66-113(198)199)135(217)181-109(71-188)139(221)176-103(64-86-40-46-90(193)47-41-86)133(215)179-107(69-186)137(219)167-95(35-28-57-157-145(153)154)128(210)174-101(62-84-36-42-88(191)43-37-84)131(213)166-94(34-27-56-156-144(151)152)126(208)164-91(31-21-24-53-146)124(206)169-97(48-50-110(149)194)129(211)170-98(52-58-226-16)123(205)161-80(13)121(203)183-114(75(6)7)140(222)171-93(33-23-26-55-148)125(207)165-92(32-22-25-54-147)127(209)175-102(63-85-38-44-89(192)45-39-85)132(214)173-100(60-74(4)5)130(212)162-78(11)119(201)160-79(12)120(202)184-115(76(8)9)141(223)172-99(118(150)200)59-73(2)3/h18-20,29-30,36-47,67,72-81,91-109,114-117,186-189,191-193H,17,21-28,31-35,48-66,68-71,146-148H2,1-16H3,(H2,149,194)(H2,150,200)(H,155,159)(H,158,204)(H,160,201)(H,161,205)(H,162,212)(H,163,190)(H,164,208)(H,165,207)(H,166,213)(H,167,219)(H,168,220)(H,169,206)(H,170,211)(H,171,222)(H,172,223)(H,173,214)(H,174,210)(H,175,209)(H,176,221)(H,177,224)(H,178,225)(H,179,215)(H,180,216)(H,181,217)(H,182,195)(H,183,203)(H,184,202)(H,185,218)(H,196,197)(H,198,199)(H4,151,152,156)(H4,153,154,157)/t77?,78-,79-,80-,81+,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,114-,115-,116-,117-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 1 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Neuropharmacology 33: 1189-95 (1994) Article DOI: 10.1016/s0028-3908(05)80009-7 BindingDB Entry DOI: 10.7270/Q2251GP3 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (Homo sapiens (Human)) | BDBM81535 (CHEMBL525267 | PACAP(6-38)) Show SMILES [#6]-[#16]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-c1ccccc1)-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](-[#7])=O |r| Show InChI InChI=1S/C182H300N56O45S/c1-95(2)83-128(152(257)207-92-141(249)211-115(40-20-27-72-184)154(259)215-122(47-34-79-204-180(197)198)161(266)226-130(86-105-50-58-109(242)59-51-105)167(272)217-117(42-22-29-74-186)156(261)220-125(66-68-138(191)246)163(268)216-124(49-36-81-206-182(201)202)165(270)237-145(99(9)10)176(281)224-120(45-25-32-77-189)160(265)230-134(90-140(193)248)171(276)212-114(147(194)252)39-19-26-71-183)231-177(282)144(98(7)8)236-149(254)101(12)208-148(253)100(11)210-166(271)129(84-96(3)4)225-169(274)132(88-107-54-62-111(244)63-55-107)228-159(264)118(43-23-30-75-187)214-157(262)119(44-24-31-76-188)223-175(280)143(97(5)6)235-150(255)102(13)209-153(258)127(70-82-284-15)222-164(269)126(67-69-139(192)247)221-155(260)116(41-21-28-73-185)213-158(263)121(46-33-78-203-179(195)196)218-168(273)131(87-106-52-60-110(243)61-53-106)227-162(267)123(48-35-80-205-181(199)200)219-173(278)136(93-239)233-170(275)133(89-108-56-64-112(245)65-57-108)229-174(279)137(94-240)234-172(277)135(91-142(250)251)232-178(283)146(103(14)241)238-151(256)113(190)85-104-37-17-16-18-38-104/h16-18,37-38,50-65,95-103,113-137,143-146,239-245H,19-36,39-49,66-94,183-190H2,1-15H3,(H2,191,246)(H2,192,247)(H2,193,248)(H2,194,252)(H,207,257)(H,208,253)(H,209,258)(H,210,271)(H,211,249)(H,212,276)(H,213,263)(H,214,262)(H,215,259)(H,216,268)(H,217,272)(H,218,273)(H,219,278)(H,220,261)(H,221,260)(H,222,269)(H,223,280)(H,224,281)(H,225,274)(H,226,266)(H,227,267)(H,228,264)(H,229,279)(H,230,265)(H,231,282)(H,232,283)(H,233,275)(H,234,277)(H,235,255)(H,236,254)(H,237,270)(H,238,256)(H,250,251)(H4,195,196,203)(H4,197,198,204)(H4,199,200,205)(H4,201,202,206)/t100-,101-,102-,103+,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,143-,144-,145-,146-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 1.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 207: 239-46 (1992) Article DOI: 10.1111/j.1432-1033.1992.tb17043.x BindingDB Entry DOI: 10.7270/Q2WM1BW2 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| VIP peptides (RAT) | BDBM50250068 (CHEMBL501240 | PACAP(1-27) | PACAP-27 | [Glu3]PACA...) Show SMILES CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(N)=O |r,wU:27.27,12.17,4.4,49.50,50.53,64.65,82.84,99.101,122.125,140.143,153.156,169.172,190.194,203.208,215.219,wD:21.23,2.2,38.38,56.57,70.71,88.90,111.114,131.134,148.152,160.163,178.181,198.203,208.212,(4.62,.39,;4.62,-1.15,;5.96,-1.91,;7.29,-1.15,;5.96,-3.45,;4.62,-4.22,;3.28,-3.45,;3.28,-1.91,;1.95,-4.22,;.62,-3.45,;-.71,-4.22,;-.71,-5.76,;-2.04,-3.45,;-2.04,-1.91,;-.71,-1.15,;-.71,.39,;-2.04,1.16,;.62,1.16,;-3.38,-4.22,;-4.72,-3.45,;-4.72,-1.91,;-6.05,-4.22,;-6.05,-5.76,;-4.72,-6.54,;-7.38,-3.45,;-8.71,-4.22,;-8.71,-5.76,;-10.04,-3.45,;-11.38,-4.22,;-10.04,-1.91,;-8.71,-1.15,;-7.3,-1.78,;-6.27,-.62,;-7.04,.71,;-8.55,.39,;7.29,-4.22,;7.29,-5.76,;8.62,-3.45,;9.95,-4.22,;9.95,-5.76,;11.28,-6.54,;12.63,-5.76,;13.96,-6.54,;13.96,-8.08,;12.63,-8.85,;11.28,-8.08,;11.28,-3.45,;11.28,-1.91,;12.62,-4.22,;13.95,-3.45,;13.95,-1.91,;12.62,-1.15,;15.29,-1.15,;15.29,-4.22,;15.29,-5.76,;16.62,-3.45,;17.95,-4.22,;17.95,-5.76,;19.28,-6.54,;20.61,-5.76,;19.28,-8.07,;19.28,-3.45,;19.28,-1.91,;20.61,-4.22,;21.95,-3.45,;21.95,-1.91,;23.29,-1.15,;23.29,-4.22,;23.29,-5.76,;24.62,-3.45,;25.95,-4.22,;25.95,-5.76,;27.28,-6.54,;28.62,-5.76,;29.96,-6.54,;29.96,-8.08,;31.29,-8.85,;28.62,-8.85,;27.28,-8.08,;27.28,-3.45,;27.28,-1.91,;28.61,-4.22,;29.95,-3.45,;29.95,-1.91,;31.29,-1.15,;31.29,-4.22,;31.29,-5.76,;32.62,-3.45,;33.95,-4.22,;33.95,-5.76,;35.28,-6.54,;35.28,-8.07,;36.61,-8.85,;36.61,-10.39,;35.28,-11.15,;37.94,-11.15,;35.28,-3.45,;35.28,-1.91,;36.61,-4.22,;37.94,-3.45,;37.94,-1.91,;39.29,-1.15,;40.62,-1.91,;41.96,-1.15,;41.96,.39,;43.29,1.17,;40.62,1.17,;39.29,.39,;39.29,-4.22,;39.29,-5.76,;40.62,-3.45,;41.95,-4.22,;41.95,-5.76,;43.28,-6.54,;43.28,-8.07,;44.61,-8.85,;44.61,-10.39,;43.28,-11.15,;45.94,-11.15,;43.28,-3.45,;43.28,-1.91,;44.61,-4.22,;45.94,-3.45,;45.94,-1.91,;47.28,-1.15,;47.28,.39,;48.62,1.16,;48.62,2.7,;47.28,-4.22,;47.28,-5.76,;48.62,-3.45,;49.95,-4.22,;49.95,-5.76,;51.28,-6.54,;51.28,-8.07,;49.95,-8.85,;52.61,-8.85,;51.28,-3.45,;51.28,-1.91,;52.61,-4.22,;53.94,-3.45,;53.94,-1.91,;55.28,-1.15,;55.28,.39,;56.62,1.16,;55.28,-4.22,;55.28,-5.76,;56.62,-3.45,;57.95,-4.22,;57.95,-5.76,;59.28,-3.45,;59.28,-1.91,;60.61,-4.22,;61.94,-3.45,;61.94,-1.91,;63.27,-1.15,;60.61,-1.15,;63.27,-4.22,;63.27,-5.76,;64.61,-3.45,;65.95,-4.22,;65.95,-5.76,;67.28,-6.54,;67.28,-8.07,;68.61,-8.85,;68.61,-10.39,;67.28,-3.45,;67.28,-1.91,;68.61,-4.22,;69.94,-3.45,;69.94,-1.91,;71.27,-1.15,;71.27,.39,;72.61,1.16,;72.61,2.7,;71.27,-4.22,;71.27,-5.76,;72.61,-3.45,;73.95,-4.22,;73.95,-5.76,;75.28,-6.54,;76.61,-5.76,;77.95,-6.54,;77.95,-8.08,;79.28,-8.85,;76.61,-8.85,;75.28,-8.08,;75.28,-3.45,;75.28,-1.91,;76.61,-4.22,;77.94,-3.45,;77.94,-1.91,;79.27,-1.15,;79.27,.39,;80.61,-1.91,;79.27,-4.22,;79.27,-5.76,;80.61,-3.45,;81.95,-4.22,;81.95,-5.76,;83.28,-3.45,;83.28,-1.91,;84.61,-4.22,;85.94,-3.45,;85.94,-1.91,;87.27,-4.22,;87.27,-5.76,;88.61,-3.45,;89.95,-4.22,;89.95,-5.76,;91.28,-6.54,;88.61,-6.54,;91.28,-3.45,;91.28,-1.91,;92.61,-4.22,;93.94,-3.45,;93.94,-1.91,;95.27,-1.15,;95.27,.39,;96.6,-1.91,;95.27,-4.22,;96.6,-3.45,;95.27,-5.76,)| Show InChI InChI=1S/C143H226N40O39S/c1-16-76(10)114(180-109(192)67-157-121(202)95(48-50-110(193)194)166-135(216)105(68-184)177-120(201)89(147)64-85-66-154-71-158-85)140(221)175-103(60-81-28-18-17-19-29-81)134(215)183-115(80(14)187)141(222)176-104(65-111(195)196)133(214)179-107(70-186)137(218)174-102(63-84-39-45-88(190)46-40-84)132(213)178-106(69-185)136(217)165-94(34-27-56-156-143(152)153)127(208)172-100(61-82-35-41-86(188)42-36-82)130(211)164-93(33-26-55-155-142(150)151)125(206)162-90(30-20-23-52-144)123(204)167-96(47-49-108(148)191)128(209)168-97(51-57-223-15)122(203)160-79(13)119(200)181-112(74(6)7)138(219)169-92(32-22-25-54-146)124(205)163-91(31-21-24-53-145)126(207)173-101(62-83-37-43-87(189)44-38-83)131(212)171-99(59-73(4)5)129(210)161-77(11)117(198)159-78(12)118(199)182-113(75(8)9)139(220)170-98(116(149)197)58-72(2)3/h17-19,28-29,35-46,66,71-80,89-107,112-115,184-190H,16,20-27,30-34,47-65,67-70,144-147H2,1-15H3,(H2,148,191)(H2,149,197)(H,154,158)(H,157,202)(H,159,198)(H,160,203)(H,161,210)(H,162,206)(H,163,205)(H,164,211)(H,165,217)(H,166,216)(H,167,204)(H,168,209)(H,169,219)(H,170,220)(H,171,212)(H,172,208)(H,173,207)(H,174,218)(H,175,221)(H,176,222)(H,177,201)(H,178,213)(H,179,214)(H,180,192)(H,181,200)(H,182,199)(H,183,215)(H,193,194)(H,195,196)(H4,150,151,155)(H4,152,153,156)/t76-,77-,78-,79-,80+,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,112-,113-,114-,115-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 1.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 195: 535-41 (1991) Article DOI: 10.1111/j.1432-1033.1991.tb15734.x BindingDB Entry DOI: 10.7270/Q2RV0M66 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (Homo sapiens (Human)) | BDBM81535 (CHEMBL525267 | PACAP(6-38)) Show SMILES [#6]-[#16]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-c1ccccc1)-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](-[#7])=O |r| Show InChI InChI=1S/C182H300N56O45S/c1-95(2)83-128(152(257)207-92-141(249)211-115(40-20-27-72-184)154(259)215-122(47-34-79-204-180(197)198)161(266)226-130(86-105-50-58-109(242)59-51-105)167(272)217-117(42-22-29-74-186)156(261)220-125(66-68-138(191)246)163(268)216-124(49-36-81-206-182(201)202)165(270)237-145(99(9)10)176(281)224-120(45-25-32-77-189)160(265)230-134(90-140(193)248)171(276)212-114(147(194)252)39-19-26-71-183)231-177(282)144(98(7)8)236-149(254)101(12)208-148(253)100(11)210-166(271)129(84-96(3)4)225-169(274)132(88-107-54-62-111(244)63-55-107)228-159(264)118(43-23-30-75-187)214-157(262)119(44-24-31-76-188)223-175(280)143(97(5)6)235-150(255)102(13)209-153(258)127(70-82-284-15)222-164(269)126(67-69-139(192)247)221-155(260)116(41-21-28-73-185)213-158(263)121(46-33-78-203-179(195)196)218-168(273)131(87-106-52-60-110(243)61-53-106)227-162(267)123(48-35-80-205-181(199)200)219-173(278)136(93-239)233-170(275)133(89-108-56-64-112(245)65-57-108)229-174(279)137(94-240)234-172(277)135(91-142(250)251)232-178(283)146(103(14)241)238-151(256)113(190)85-104-37-17-16-18-38-104/h16-18,37-38,50-65,95-103,113-137,143-146,239-245H,19-36,39-49,66-94,183-190H2,1-15H3,(H2,191,246)(H2,192,247)(H2,193,248)(H2,194,252)(H,207,257)(H,208,253)(H,209,258)(H,210,271)(H,211,249)(H,212,276)(H,213,263)(H,214,262)(H,215,259)(H,216,268)(H,217,272)(H,218,273)(H,219,278)(H,220,261)(H,221,260)(H,222,269)(H,223,280)(H,224,281)(H,225,274)(H,226,266)(H,227,267)(H,228,264)(H,229,279)(H,230,265)(H,231,282)(H,232,283)(H,233,275)(H,234,277)(H,235,255)(H,236,254)(H,237,270)(H,238,256)(H,250,251)(H4,195,196,203)(H4,197,198,204)(H4,199,200,205)(H4,201,202,206)/t100-,101-,102-,103+,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,143-,144-,145-,146-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 1.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 208: 815-9 (1992) Article DOI: 10.1111/j.1432-1033.1992.tb17252.x BindingDB Entry DOI: 10.7270/Q2J67FD2 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| VIP peptides (Homo sapiens (Human)) | BDBM82356 (PACAP(2-38)) Show SMILES [#6]-[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#16]-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](-[#7])=O |r| Show InChI InChI=1S/C197H324N60O52S/c1-18-106(12)157(253-151(270)97-223-165(281)143(94-152(271)272)241-163(279)120(205)98-258)192(308)249-141(88-111-40-20-19-21-41-111)186(302)257-158(110(16)261)193(309)250-144(95-153(273)274)185(301)252-146(100-260)188(304)246-140(92-115-59-67-119(265)68-60-115)183(299)251-145(99-259)187(303)235-130(51-38-83-220-196(214)215)175(291)244-138(90-113-55-63-117(263)64-56-113)181(297)234-128(49-36-81-218-194(210)211)171(287)229-123(44-24-31-76-200)168(284)237-133(70-72-148(207)267)177(293)238-134(73-85-310-17)166(282)225-109(15)162(278)254-154(103(6)7)189(305)239-126(47-27-34-79-203)170(286)230-125(46-26-33-78-202)172(288)245-139(91-114-57-65-118(264)66-58-114)182(298)242-136(87-102(4)5)179(295)226-107(13)160(276)224-108(14)161(277)255-155(104(8)9)191(307)248-135(86-101(2)3)164(280)222-96-150(269)227-122(43-23-30-75-199)167(283)231-129(50-37-82-219-195(212)213)174(290)243-137(89-112-53-61-116(262)62-54-112)180(296)233-124(45-25-32-77-201)169(285)236-132(69-71-147(206)266)176(292)232-131(52-39-84-221-197(216)217)178(294)256-156(105(10)11)190(306)240-127(48-28-35-80-204)173(289)247-142(93-149(208)268)184(300)228-121(159(209)275)42-22-29-74-198/h19-21,40-41,53-68,101-110,120-146,154-158,258-265H,18,22-39,42-52,69-100,198-205H2,1-17H3,(H2,206,266)(H2,207,267)(H2,208,268)(H2,209,275)(H,222,280)(H,223,281)(H,224,276)(H,225,282)(H,226,295)(H,227,269)(H,228,300)(H,229,287)(H,230,286)(H,231,283)(H,232,292)(H,233,296)(H,234,297)(H,235,303)(H,236,285)(H,237,284)(H,238,293)(H,239,305)(H,240,306)(H,241,279)(H,242,298)(H,243,290)(H,244,291)(H,245,288)(H,246,304)(H,247,289)(H,248,307)(H,249,308)(H,250,309)(H,251,299)(H,252,301)(H,253,270)(H,254,278)(H,255,277)(H,256,294)(H,257,302)(H,271,272)(H,273,274)(H4,210,211,218)(H4,212,213,219)(H4,214,215,220)(H4,216,217,221)/t106?,107-,108-,109-,110+,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,142-,143-,144-,145-,146-,154-,155-,156-,157-,158-/m0/s1 | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 195: 535-41 (1991) Article DOI: 10.1111/j.1432-1033.1991.tb15734.x BindingDB Entry DOI: 10.7270/Q2RV0M66 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (RAT) | BDBM81524 ([Phe2]PACAP(1-38)) Show SMILES CCC(C)[C@H](NC(=O)CNC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(N)=O |r| Show InChI InChI=1S/C209H335N63O52S/c1-18-114(12)168(268-162(284)105-236-176(295)154(101-163(285)286)262-193(312)147(93-119-43-21-19-22-44-119)255-174(293)130(217)99-125-103-230-108-237-125)204(323)264-152(94-120-45-23-20-24-46-120)198(317)272-169(118(16)275)205(324)265-155(102-164(287)288)197(316)267-157(107-274)200(319)260-151(98-124-64-72-129(279)73-65-124)195(314)266-156(106-273)199(318)249-140(56-41-88-233-208(226)227)186(305)258-149(96-122-60-68-127(277)69-61-122)192(311)248-138(54-39-86-231-206(222)223)182(301)243-133(49-27-34-81-212)179(298)251-143(75-77-159(219)281)188(307)252-144(78-90-325-17)177(296)239-117(15)173(292)269-165(111(6)7)201(320)253-136(52-30-37-84-215)181(300)244-135(51-29-36-83-214)183(302)259-150(97-123-62-70-128(278)71-63-123)194(313)256-146(92-110(4)5)190(309)240-115(13)171(290)238-116(14)172(291)270-166(112(8)9)203(322)263-145(91-109(2)3)175(294)235-104-161(283)241-132(48-26-33-80-211)178(297)245-139(55-40-87-232-207(224)225)185(304)257-148(95-121-58-66-126(276)67-59-121)191(310)247-134(50-28-35-82-213)180(299)250-142(74-76-158(218)280)187(306)246-141(57-42-89-234-209(228)229)189(308)271-167(113(10)11)202(321)254-137(53-31-38-85-216)184(303)261-153(100-160(220)282)196(315)242-131(170(221)289)47-25-32-79-210/h19-24,43-46,58-73,103,108-118,130-157,165-169,273-279H,18,25-42,47-57,74-102,104-107,210-217H2,1-17H3,(H2,218,280)(H2,219,281)(H2,220,282)(H2,221,289)(H,230,237)(H,235,294)(H,236,295)(H,238,290)(H,239,296)(H,240,309)(H,241,283)(H,242,315)(H,243,301)(H,244,300)(H,245,297)(H,246,306)(H,247,310)(H,248,311)(H,249,318)(H,250,299)(H,251,298)(H,252,307)(H,253,320)(H,254,321)(H,255,293)(H,256,313)(H,257,304)(H,258,305)(H,259,302)(H,260,319)(H,261,303)(H,262,312)(H,263,322)(H,264,323)(H,265,324)(H,266,314)(H,267,316)(H,268,284)(H,269,292)(H,270,291)(H,271,308)(H,272,317)(H,285,286)(H,287,288)(H4,222,223,231)(H4,224,225,232)(H4,226,227,233)(H4,228,229,234)/t114?,115-,116-,117-,118+,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,142-,143-,144-,145-,146-,147-,148-,149-,150-,151-,152-,153-,154-,155-,156-,157-,165-,166-,167-,168-,169-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Neuropharmacology 33: 1189-95 (1994) Article DOI: 10.1016/s0028-3908(05)80009-7 BindingDB Entry DOI: 10.7270/Q2251GP3 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (RAT) | BDBM81535 (CHEMBL525267 | PACAP(6-38)) Show SMILES [#6]-[#16]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-c1ccccc1)-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](-[#7])=O |r| Show InChI InChI=1S/C182H300N56O45S/c1-95(2)83-128(152(257)207-92-141(249)211-115(40-20-27-72-184)154(259)215-122(47-34-79-204-180(197)198)161(266)226-130(86-105-50-58-109(242)59-51-105)167(272)217-117(42-22-29-74-186)156(261)220-125(66-68-138(191)246)163(268)216-124(49-36-81-206-182(201)202)165(270)237-145(99(9)10)176(281)224-120(45-25-32-77-189)160(265)230-134(90-140(193)248)171(276)212-114(147(194)252)39-19-26-71-183)231-177(282)144(98(7)8)236-149(254)101(12)208-148(253)100(11)210-166(271)129(84-96(3)4)225-169(274)132(88-107-54-62-111(244)63-55-107)228-159(264)118(43-23-30-75-187)214-157(262)119(44-24-31-76-188)223-175(280)143(97(5)6)235-150(255)102(13)209-153(258)127(70-82-284-15)222-164(269)126(67-69-139(192)247)221-155(260)116(41-21-28-73-185)213-158(263)121(46-33-78-203-179(195)196)218-168(273)131(87-106-52-60-110(243)61-53-106)227-162(267)123(48-35-80-205-181(199)200)219-173(278)136(93-239)233-170(275)133(89-108-56-64-112(245)65-57-108)229-174(279)137(94-240)234-172(277)135(91-142(250)251)232-178(283)146(103(14)241)238-151(256)113(190)85-104-37-17-16-18-38-104/h16-18,37-38,50-65,95-103,113-137,143-146,239-245H,19-36,39-49,66-94,183-190H2,1-15H3,(H2,191,246)(H2,192,247)(H2,193,248)(H2,194,252)(H,207,257)(H,208,253)(H,209,258)(H,210,271)(H,211,249)(H,212,276)(H,213,263)(H,214,262)(H,215,259)(H,216,268)(H,217,272)(H,218,273)(H,219,278)(H,220,261)(H,221,260)(H,222,269)(H,223,280)(H,224,281)(H,225,274)(H,226,266)(H,227,267)(H,228,264)(H,229,279)(H,230,265)(H,231,282)(H,232,283)(H,233,275)(H,234,277)(H,235,255)(H,236,254)(H,237,270)(H,238,256)(H,250,251)(H4,195,196,203)(H4,197,198,204)(H4,199,200,205)(H4,201,202,206)/t100-,101-,102-,103+,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,143-,144-,145-,146-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Neuropharmacology 33: 1189-95 (1994) Article DOI: 10.1016/s0028-3908(05)80009-7 BindingDB Entry DOI: 10.7270/Q2251GP3 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (RAT) | BDBM82356 (PACAP(2-38)) Show SMILES [#6]-[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#16]-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](-[#7])=O |r| Show InChI InChI=1S/C197H324N60O52S/c1-18-106(12)157(253-151(270)97-223-165(281)143(94-152(271)272)241-163(279)120(205)98-258)192(308)249-141(88-111-40-20-19-21-41-111)186(302)257-158(110(16)261)193(309)250-144(95-153(273)274)185(301)252-146(100-260)188(304)246-140(92-115-59-67-119(265)68-60-115)183(299)251-145(99-259)187(303)235-130(51-38-83-220-196(214)215)175(291)244-138(90-113-55-63-117(263)64-56-113)181(297)234-128(49-36-81-218-194(210)211)171(287)229-123(44-24-31-76-200)168(284)237-133(70-72-148(207)267)177(293)238-134(73-85-310-17)166(282)225-109(15)162(278)254-154(103(6)7)189(305)239-126(47-27-34-79-203)170(286)230-125(46-26-33-78-202)172(288)245-139(91-114-57-65-118(264)66-58-114)182(298)242-136(87-102(4)5)179(295)226-107(13)160(276)224-108(14)161(277)255-155(104(8)9)191(307)248-135(86-101(2)3)164(280)222-96-150(269)227-122(43-23-30-75-199)167(283)231-129(50-37-82-219-195(212)213)174(290)243-137(89-112-53-61-116(262)62-54-112)180(296)233-124(45-25-32-77-201)169(285)236-132(69-71-147(206)266)176(292)232-131(52-39-84-221-197(216)217)178(294)256-156(105(10)11)190(306)240-127(48-28-35-80-204)173(289)247-142(93-149(208)268)184(300)228-121(159(209)275)42-22-29-74-198/h19-21,40-41,53-68,101-110,120-146,154-158,258-265H,18,22-39,42-52,69-100,198-205H2,1-17H3,(H2,206,266)(H2,207,267)(H2,208,268)(H2,209,275)(H,222,280)(H,223,281)(H,224,276)(H,225,282)(H,226,295)(H,227,269)(H,228,300)(H,229,287)(H,230,286)(H,231,283)(H,232,292)(H,233,296)(H,234,297)(H,235,303)(H,236,285)(H,237,284)(H,238,293)(H,239,305)(H,240,306)(H,241,279)(H,242,298)(H,243,290)(H,244,291)(H,245,288)(H,246,304)(H,247,289)(H,248,307)(H,249,308)(H,250,309)(H,251,299)(H,252,301)(H,253,270)(H,254,278)(H,255,277)(H,256,294)(H,257,302)(H,271,272)(H,273,274)(H4,210,211,218)(H4,212,213,219)(H4,214,215,220)(H4,216,217,221)/t106?,107-,108-,109-,110+,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,142-,143-,144-,145-,146-,154-,155-,156-,157-,158-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Neuropharmacology 33: 1189-95 (1994) Article DOI: 10.1016/s0028-3908(05)80009-7 BindingDB Entry DOI: 10.7270/Q2251GP3 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| VIP peptides (RAT) | BDBM82360 ([Ser9,Tyr13]VIP) Show SMILES CCC(C)C(NC(=O)C(CO)NC(=O)C(CC(N)=O)NC(=O)C(CC(C)C)NC(=O)C(Cc1ccc(O)cc1)NC(=O)C(CCCCN)NC(=O)C(CCCCN)NC(=O)C(NC(=O)C(C)NC(=O)C(CCSC)NC(=O)C(CCC(N)=O)NC(=O)C(CCCCN)NC(=O)C(CCCN=C(N)N)NC(=O)C(Cc1ccc(O)cc1)NC(=O)C(CCCN=C(N)N)NC(=O)C(NC(=O)C(Cc1ccc(O)cc1)NC(=O)C(CO)NC(=O)C(CC(O)=O)NC(=O)C(NC(=O)C(Cc1ccccc1)NC(=O)C(NC(=O)C(C)NC(=O)C(CC(O)=O)NC(=O)C(CO)NC(=O)C(N)Cc1cnc[nH]1)C(C)C)C(C)O)C(C)O)C(C)C)C(=O)NC(CC(C)C)C(=O)NC(CC(N)=O)C(O)=O |(16.32,19.93,;16.32,18.39,;17.66,17.62,;18.99,18.39,;17.66,16.08,;18.99,15.31,;20.53,16.08,;20.53,17.62,;21.86,15.31,;21.86,13.77,;20.53,13,;23.2,16.08,;24.74,15.31,;24.74,13.77,;26.07,16.08,;26.07,17.62,;24.74,18.39,;24.74,19.93,;23.4,17.62,;27.41,15.31,;28.95,16.08,;28.95,17.62,;30.28,15.31,;30.28,13.77,;28.95,13,;28.95,11.46,;27.61,13.77,;31.61,16.08,;33.15,15.31,;33.15,13.77,;34.49,16.08,;34.49,17.62,;35.82,18.39,;37.15,17.62,;38.49,18.39,;38.49,19.93,;39.82,20.7,;37.15,20.7,;35.82,19.93,;35.82,15.31,;35.1,4.53,;35.1,2.99,;33.76,5.3,;33.76,6.84,;35.1,7.61,;36.43,6.84,;37.77,7.61,;39.1,6.84,;32.43,4.53,;30.89,5.3,;30.89,6.84,;29.56,4.53,;29.56,2.99,;30.89,2.22,;30.89,.68,;32.22,-.09,;33.56,.68,;28.22,5.3,;26.68,4.53,;26.68,2.99,;25.35,5.3,;24.02,4.53,;22.48,5.3,;22.48,6.84,;21.14,4.53,;21.14,2.99,;19.81,5.3,;18.27,4.53,;18.27,2.99,;16.93,5.3,;16.93,6.84,;18.27,7.61,;18.27,9.15,;16.93,9.92,;15.6,4.53,;14.06,5.3,;14.06,6.84,;12.73,4.53,;12.73,2.99,;14.06,2.22,;14.06,.68,;12.73,-.09,;15.39,-.09,;11.39,5.3,;9.85,4.53,;9.85,2.99,;8.52,5.3,;8.52,6.84,;7.19,7.61,;7.19,9.15,;5.85,9.92,;4.52,9.15,;7.19,4.53,;7.91,-6.25,;7.91,-7.79,;9.24,-5.48,;9.24,-3.94,;7.91,-3.17,;7.91,-1.63,;6.57,-.86,;5.24,-1.63,;3.91,-.86,;5.24,-3.17,;10.58,-6.25,;12.12,-5.48,;12.12,-3.94,;13.45,-6.25,;13.45,-7.79,;12.22,-8.2,;10.89,-7.43,;9.56,-8.2,;9.56,-9.74,;8.07,-10.13,;10.89,-10.51,;12.22,-9.74,;14.78,-5.48,;16.32,-6.25,;16.32,-7.79,;17.66,-5.48,;17.66,-3.94,;16.32,-3.17,;16.32,-1.63,;17.66,-.86,;17.66,.68,;18.99,1.45,;16.32,1.45,;18.99,-6.25,;20.53,-5.48,;20.53,-3.94,;21.86,-6.25,;23.2,-5.48,;24.74,-6.25,;24.74,-7.79,;26.07,-5.48,;26.07,-3.94,;24.74,-3.17,;24.74,-1.63,;23.4,-.86,;22.07,-1.63,;20.74,-.86,;22.07,-3.17,;23.4,-3.94,;27.41,-6.25,;28.95,-5.48,;28.95,-3.94,;30.28,-6.25,;30.28,-7.79,;28.95,-8.56,;31.61,-5.48,;33.15,-6.25,;33.15,-7.79,;34.49,-5.48,;34.49,-3.94,;35.82,-3.17,;35.82,-1.63,;37.15,-3.94,;35.82,-6.25,;35.1,-17.03,;35.1,-18.57,;33.76,-16.26,;32.43,-17.03,;30.89,-16.26,;30.89,-14.72,;29.56,-17.03,;29.56,-18.57,;30.89,-19.34,;30.89,-20.88,;32.22,-21.65,;33.56,-20.88,;33.56,-19.34,;32.22,-18.57,;28.22,-16.26,;26.68,-17.03,;26.68,-18.57,;25.35,-16.26,;24.02,-17.03,;22.48,-16.26,;22.48,-14.72,;21.14,-17.03,;21.14,-18.57,;19.81,-16.26,;18.27,-17.03,;18.27,-18.57,;16.93,-16.26,;16.93,-14.72,;18.27,-13.95,;18.27,-12.41,;19.6,-14.72,;15.6,-17.03,;14.06,-16.26,;14.06,-14.72,;12.73,-17.03,;12.73,-18.57,;14.06,-19.34,;11.39,-16.26,;9.85,-17.03,;9.85,-18.57,;8.52,-16.26,;7.19,-17.03,;8.52,-14.72,;7.19,-13.95,;7.03,-12.42,;5.52,-12.1,;4.75,-13.43,;5.78,-14.58,;25.35,-14.72,;26.68,-13.95,;24.02,-13.95,;33.76,-14.72,;32.43,-13.95,;35.1,-13.95,;21.86,-7.79,;23.2,-8.56,;20.53,-8.56,;25.35,6.84,;26.68,7.61,;24.02,7.61,;16.32,15.31,;16.32,13.77,;14.78,16.08,;13.45,15.31,;13.45,13.77,;12.12,13,;12.12,11.46,;10.78,13.77,;12.12,16.08,;12.12,17.62,;10.58,15.31,;9.24,16.08,;9.24,17.62,;7.91,18.39,;7.91,19.93,;6.57,17.62,;7.91,15.31,;6.57,16.08,;7.91,13.77,)| Show InChI InChI=1S/C149H234N42O44S/c1-16-76(10)117(144(231)180-98(57-73(4)5)132(219)183-106(147(234)235)64-112(156)202)189-141(228)109(70-194)186-135(222)103(63-111(155)201)178-131(218)97(56-72(2)3)174-134(221)100(60-83-37-43-87(198)44-38-83)176-127(214)91(31-21-24-51-151)168-125(212)92(32-22-25-52-152)172-142(229)115(74(6)7)187-120(207)77(11)165-123(210)96(49-55-236-15)171-129(216)95(47-48-110(154)200)170-124(211)90(30-20-23-50-150)167-126(213)93(33-26-53-162-148(157)158)169-133(220)99(59-82-35-41-86(197)42-36-82)175-128(215)94(34-27-54-163-149(159)160)173-145(232)118(79(13)195)190-137(224)101(61-84-39-45-88(199)46-40-84)177-140(227)108(69-193)185-136(223)105(66-114(205)206)182-146(233)119(80(14)196)191-138(225)102(58-81-28-18-17-19-29-81)181-143(230)116(75(8)9)188-121(208)78(12)166-130(217)104(65-113(203)204)179-139(226)107(68-192)184-122(209)89(153)62-85-67-161-71-164-85/h17-19,28-29,35-46,67,71-80,89-109,115-119,192-199H,16,20-27,30-34,47-66,68-70,150-153H2,1-15H3,(H2,154,200)(H2,155,201)(H2,156,202)(H,161,164)(H,165,210)(H,166,217)(H,167,213)(H,168,212)(H,169,220)(H,170,211)(H,171,216)(H,172,229)(H,173,232)(H,174,221)(H,175,215)(H,176,214)(H,177,227)(H,178,218)(H,179,226)(H,180,231)(H,181,230)(H,182,233)(H,183,219)(H,184,209)(H,185,223)(H,186,222)(H,187,207)(H,188,208)(H,189,228)(H,190,224)(H,191,225)(H,203,204)(H,205,206)(H,234,235)(H4,157,158,162)(H4,159,160,163) | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 195: 535-41 (1991) Article DOI: 10.1111/j.1432-1033.1991.tb15734.x BindingDB Entry DOI: 10.7270/Q2RV0M66 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (RAT) | BDBM82440 (PACAP(6-31)) Show SMILES [#6]-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#16]-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-c1ccccc1)-[#6@@H](-[#6])-[#8])-[#6](-[#6])-[#6])-[#6](-[#6])-[#6] |r| Show InChI InChI=1S/C145H231N41O36S/c1-76(2)65-103(123(203)162-73-113(195)166-94(31-18-22-57-146)125(205)169-99(36-27-62-160-144(154)155)130(210)176-105(122(202)158-13)68-85-38-46-89(190)47-39-85)180-141(221)116(79(7)8)185-119(199)81(10)163-118(198)80(9)165-133(213)104(66-77(3)4)175-135(215)107(70-87-42-50-91(192)51-43-87)178-129(209)96(33-20-24-59-148)168-127(207)97(34-21-25-60-149)174-140(220)115(78(5)6)184-120(200)82(11)164-124(204)102(56-64-223-14)173-132(212)101(54-55-112(151)194)172-126(206)95(32-19-23-58-147)167-128(208)98(35-26-61-159-143(152)153)170-134(214)106(69-86-40-48-90(191)49-41-86)177-131(211)100(37-28-63-161-145(156)157)171-138(218)110(74-187)182-136(216)108(71-88-44-52-92(193)53-45-88)179-139(219)111(75-188)183-137(217)109(72-114(196)197)181-142(222)117(83(12)189)186-121(201)93(150)67-84-29-16-15-17-30-84/h15-17,29-30,38-53,76-83,93-111,115-117,187-193H,18-28,31-37,54-75,146-150H2,1-14H3,(H2,151,194)(H,158,202)(H,162,203)(H,163,198)(H,164,204)(H,165,213)(H,166,195)(H,167,208)(H,168,207)(H,169,205)(H,170,214)(H,171,218)(H,172,206)(H,173,212)(H,174,220)(H,175,215)(H,176,210)(H,177,211)(H,178,209)(H,179,219)(H,180,221)(H,181,222)(H,182,216)(H,183,217)(H,184,200)(H,185,199)(H,186,201)(H,196,197)(H4,152,153,159)(H4,154,155,160)(H4,156,157,161)/t80-,81-,82-,83+,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110-,111-,115-,116-,117-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Neuropharmacology 33: 1189-95 (1994) Article DOI: 10.1016/s0028-3908(05)80009-7 BindingDB Entry DOI: 10.7270/Q2251GP3 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| VIP peptides (RAT) | BDBM81828 (CAS_37221-79-7 | VIP(4-28) | Vasoactive intestinal...) Show SMILES CCC(C)C(NC(=O)C(CO)NC(=O)C(CC(N)=O)NC(=O)C(CC(C)C)NC(=O)C(Cc1ccc(O)cc1)NC(=O)C(CCCCN)NC(=O)C(CCCCN)NC(=O)C(NC(=O)C(C)NC(=O)C(CCSC)NC(=O)C(CCC(N)=O)NC(=O)C(CCCCN)NC(=O)C(CCCN=C(N)N)NC(=O)C(CC(C)C)NC(=O)C(CCCN=C(N)N)NC(=O)C(NC(=O)C(Cc1ccc(O)cc1)NC(=O)C(CC(N)=O)NC(=O)C(CC(O)=O)NC(=O)C(NC(=O)C(Cc1ccccc1)NC(=O)C(NC(=O)C(C)NC(=O)C(CC(O)=O)NC(=O)C(CO)NC(=O)C(N)Cc1cnc[nH]1)C(C)C)C(C)O)C(C)O)C(C)C)C(=O)NC(CC(C)C)C(=O)NC(CC(N)=O)C(O)=O |(16.32,19.93,;16.32,18.39,;17.66,17.62,;18.99,18.39,;17.66,16.08,;18.99,15.31,;20.53,16.08,;20.53,17.62,;21.86,15.31,;21.86,13.77,;20.53,13,;23.2,16.08,;24.74,15.31,;24.74,13.77,;26.07,16.08,;26.07,17.62,;24.74,18.39,;24.74,19.93,;23.4,17.62,;27.41,15.31,;28.95,16.08,;28.95,17.62,;30.28,15.31,;30.28,13.77,;28.95,13,;28.95,11.46,;27.61,13.77,;31.61,16.08,;33.15,15.31,;33.15,13.77,;34.49,16.08,;34.49,17.62,;35.82,18.39,;37.15,17.62,;38.49,18.39,;38.49,19.93,;39.82,20.7,;37.15,20.7,;35.82,19.93,;35.82,15.31,;35.1,4.53,;35.1,2.99,;33.76,5.3,;33.76,6.84,;35.1,7.61,;36.43,6.84,;37.77,7.61,;39.1,6.84,;32.43,4.53,;30.89,5.3,;30.89,6.84,;29.56,4.53,;29.56,2.99,;30.89,2.22,;30.89,.68,;32.22,-.09,;33.56,.68,;28.22,5.3,;26.68,4.53,;26.68,2.99,;25.35,5.3,;24.02,4.53,;22.48,5.3,;22.48,6.84,;21.14,4.53,;21.14,2.99,;19.81,5.3,;18.27,4.53,;18.27,2.99,;16.93,5.3,;16.93,6.84,;18.27,7.61,;18.27,9.15,;16.93,9.92,;15.6,4.53,;14.06,5.3,;14.06,6.84,;12.73,4.53,;12.73,2.99,;14.06,2.22,;14.06,.68,;12.73,-.09,;15.39,-.09,;11.39,5.3,;9.85,4.53,;9.85,2.99,;8.52,5.3,;8.52,6.84,;7.19,7.61,;7.19,9.15,;5.85,9.92,;4.52,9.15,;7.19,4.53,;7.91,-6.25,;7.91,-7.79,;9.24,-5.48,;9.24,-3.94,;7.91,-3.17,;7.91,-1.63,;6.57,-.86,;5.24,-1.63,;3.91,-.86,;5.24,-3.17,;10.58,-6.25,;12.12,-5.48,;12.12,-3.94,;13.45,-6.25,;13.45,-7.79,;12.12,-8.56,;12.12,-10.1,;10.78,-7.79,;14.78,-5.48,;16.32,-6.25,;16.32,-7.79,;17.66,-5.48,;17.66,-3.94,;16.32,-3.17,;16.32,-1.63,;17.66,-.86,;17.66,.68,;18.99,1.45,;16.32,1.45,;18.99,-6.25,;20.53,-5.48,;20.53,-3.94,;21.86,-6.25,;23.2,-5.48,;24.74,-6.25,;24.74,-7.79,;26.07,-5.48,;26.07,-3.94,;24.74,-3.17,;24.74,-1.63,;23.4,-.86,;22.07,-1.63,;20.74,-.86,;22.07,-3.17,;23.4,-3.94,;27.41,-6.25,;28.95,-5.48,;28.95,-3.94,;30.28,-6.25,;30.28,-7.79,;28.95,-8.56,;28.95,-10.1,;27.61,-7.79,;31.61,-5.48,;33.15,-6.25,;33.15,-7.79,;34.49,-5.48,;34.49,-3.94,;35.82,-3.17,;35.82,-1.63,;37.15,-3.94,;35.82,-6.25,;35.1,-17.03,;35.1,-18.57,;33.76,-16.26,;32.43,-17.03,;30.89,-16.26,;30.89,-14.72,;29.56,-17.03,;29.56,-18.57,;30.89,-19.34,;30.89,-20.88,;32.22,-21.65,;33.56,-20.88,;33.56,-19.34,;32.22,-18.57,;28.22,-16.26,;26.68,-17.03,;26.68,-18.57,;25.35,-16.26,;24.02,-17.03,;22.48,-16.26,;22.48,-14.72,;21.14,-17.03,;21.14,-18.57,;19.81,-16.26,;18.27,-17.03,;18.27,-18.57,;16.93,-16.26,;16.93,-14.72,;18.27,-13.95,;18.27,-12.41,;19.6,-14.72,;15.6,-17.03,;14.06,-16.26,;14.06,-14.72,;12.73,-17.03,;12.73,-18.57,;14.06,-19.34,;11.39,-16.26,;9.85,-17.03,;9.85,-18.57,;8.52,-16.26,;7.19,-17.03,;8.52,-14.72,;7.19,-13.95,;7.03,-12.42,;5.52,-12.1,;4.75,-13.43,;5.78,-14.58,;25.35,-14.72,;26.68,-13.95,;24.02,-13.95,;33.76,-14.72,;32.43,-13.95,;35.1,-13.95,;21.86,-7.79,;23.2,-8.56,;20.53,-8.56,;25.35,6.84,;26.68,7.61,;24.02,7.61,;16.32,15.31,;16.32,13.77,;14.78,16.08,;13.45,15.31,;13.45,13.77,;12.12,13,;12.12,11.46,;10.78,13.77,;12.12,16.08,;12.12,17.62,;10.58,15.31,;9.24,16.08,;9.24,17.62,;7.91,18.39,;7.91,19.93,;6.57,17.62,;7.91,15.31,;6.57,16.08,;7.91,13.77,)| Show InChI InChI=1S/C147H237N43O43S/c1-18-75(12)115(142(229)180-96(56-72(6)7)131(218)183-104(145(232)233)63-110(155)200)188-139(226)106(68-192)185-134(221)101(62-109(154)199)177-130(217)95(55-71(4)5)174-132(219)97(58-81-37-41-84(195)42-38-81)175-125(212)88(33-23-26-49-149)167-123(210)89(34-24-27-50-150)171-140(227)113(73(8)9)186-118(205)76(13)164-121(208)93(47-53-234-17)170-127(214)92(45-46-107(152)197)169-122(209)87(32-22-25-48-148)166-124(211)90(35-28-51-161-146(156)157)168-129(216)94(54-70(2)3)173-126(213)91(36-29-52-162-147(158)159)172-143(230)116(78(15)193)189-136(223)98(59-82-39-43-85(196)44-40-82)176-133(220)100(61-108(153)198)178-135(222)103(65-112(203)204)182-144(231)117(79(16)194)190-137(224)99(57-80-30-20-19-21-31-80)181-141(228)114(74(10)11)187-119(206)77(14)165-128(215)102(64-111(201)202)179-138(225)105(67-191)184-120(207)86(151)60-83-66-160-69-163-83/h19-21,30-31,37-44,66,69-79,86-106,113-117,191-196H,18,22-29,32-36,45-65,67-68,148-151H2,1-17H3,(H2,152,197)(H2,153,198)(H2,154,199)(H2,155,200)(H,160,163)(H,164,208)(H,165,215)(H,166,211)(H,167,210)(H,168,216)(H,169,209)(H,170,214)(H,171,227)(H,172,230)(H,173,213)(H,174,219)(H,175,212)(H,176,220)(H,177,217)(H,178,222)(H,179,225)(H,180,229)(H,181,228)(H,182,231)(H,183,218)(H,184,207)(H,185,221)(H,186,205)(H,187,206)(H,188,226)(H,189,223)(H,190,224)(H,201,202)(H,203,204)(H,232,233)(H4,156,157,161)(H4,158,159,162) | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 195: 535-41 (1991) Article DOI: 10.1111/j.1432-1033.1991.tb15734.x BindingDB Entry DOI: 10.7270/Q2RV0M66 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| VIP peptides (RAT) | BDBM82359 ([Ser9]VIP) Show SMILES CCC(C)C(NC(=O)C(CO)NC(=O)C(CC(N)=O)NC(=O)C(CC(C)C)NC(=O)C(Cc1ccc(O)cc1)NC(=O)C(CCCCN)NC(=O)C(CCCCN)NC(=O)C(NC(=O)C(C)NC(=O)C(CCSC)NC(=O)C(CCC(N)=O)NC(=O)C(CCCCN)NC(=O)C(CCCN=C(N)N)NC(=O)C(CC(C)C)NC(=O)C(CCCN=C(N)N)NC(=O)C(NC(=O)C(Cc1ccc(O)cc1)NC(=O)C(CO)NC(=O)C(CC(O)=O)NC(=O)C(NC(=O)C(Cc1ccccc1)NC(=O)C(NC(=O)C(C)NC(=O)C(CC(O)=O)NC(=O)C(CO)NC(=O)C(N)Cc1cnc[nH]1)C(C)C)C(C)O)C(C)O)C(C)C)C(=O)NC(CC(C)C)C(=O)NC(CC(N)=O)C(O)=O |(16.32,19.93,;16.32,18.39,;17.66,17.62,;18.99,18.39,;17.66,16.08,;18.99,15.31,;20.53,16.08,;20.53,17.62,;21.86,15.31,;21.86,13.77,;20.53,13,;23.2,16.08,;24.74,15.31,;24.74,13.77,;26.07,16.08,;26.07,17.62,;24.74,18.39,;24.74,19.93,;23.4,17.62,;27.41,15.31,;28.95,16.08,;28.95,17.62,;30.28,15.31,;30.28,13.77,;28.95,13,;28.95,11.46,;27.61,13.77,;31.61,16.08,;33.15,15.31,;33.15,13.77,;34.49,16.08,;34.49,17.62,;35.82,18.39,;37.15,17.62,;38.49,18.39,;38.49,19.93,;39.82,20.7,;37.15,20.7,;35.82,19.93,;35.82,15.31,;35.1,4.53,;35.1,2.99,;33.76,5.3,;33.76,6.84,;35.1,7.61,;36.43,6.84,;37.77,7.61,;39.1,6.84,;32.43,4.53,;30.89,5.3,;30.89,6.84,;29.56,4.53,;29.56,2.99,;30.89,2.22,;30.89,.68,;32.22,-.09,;33.56,.68,;28.22,5.3,;26.68,4.53,;26.68,2.99,;25.35,5.3,;24.02,4.53,;22.48,5.3,;22.48,6.84,;21.14,4.53,;21.14,2.99,;19.81,5.3,;18.27,4.53,;18.27,2.99,;16.93,5.3,;16.93,6.84,;18.27,7.61,;18.27,9.15,;16.93,9.92,;15.6,4.53,;14.06,5.3,;14.06,6.84,;12.73,4.53,;12.73,2.99,;14.06,2.22,;14.06,.68,;12.73,-.09,;15.39,-.09,;11.39,5.3,;9.85,4.53,;9.85,2.99,;8.52,5.3,;8.52,6.84,;7.19,7.61,;7.19,9.15,;5.85,9.92,;4.52,9.15,;7.19,4.53,;7.91,-6.25,;7.91,-7.79,;9.24,-5.48,;9.24,-3.94,;7.91,-3.17,;7.91,-1.63,;6.57,-.86,;5.24,-1.63,;3.91,-.86,;5.24,-3.17,;10.58,-6.25,;12.12,-5.48,;12.12,-3.94,;13.45,-6.25,;13.45,-7.79,;12.12,-8.56,;12.12,-10.1,;10.78,-7.79,;14.78,-5.48,;16.32,-6.25,;16.32,-7.79,;17.66,-5.48,;17.66,-3.94,;16.32,-3.17,;16.32,-1.63,;17.66,-.86,;17.66,.68,;18.99,1.45,;16.32,1.45,;18.99,-6.25,;20.53,-5.48,;20.53,-3.94,;21.86,-6.25,;23.2,-5.48,;24.74,-6.25,;24.74,-7.79,;26.07,-5.48,;26.07,-3.94,;24.74,-3.17,;24.74,-1.63,;23.4,-.86,;22.07,-1.63,;20.74,-.86,;22.07,-3.17,;23.4,-3.94,;27.41,-6.25,;28.95,-5.48,;28.95,-3.94,;30.28,-6.25,;30.28,-7.79,;28.95,-8.56,;31.61,-5.48,;33.15,-6.25,;33.15,-7.79,;34.49,-5.48,;34.49,-3.94,;35.82,-3.17,;35.82,-1.63,;37.15,-3.94,;35.82,-6.25,;35.1,-17.03,;35.1,-18.57,;33.76,-16.26,;32.43,-17.03,;30.89,-16.26,;30.89,-14.72,;29.56,-17.03,;29.56,-18.57,;30.89,-19.34,;30.89,-20.88,;32.22,-21.65,;33.56,-20.88,;33.56,-19.34,;32.22,-18.57,;28.22,-16.26,;26.68,-17.03,;26.68,-18.57,;25.35,-16.26,;24.02,-17.03,;22.48,-16.26,;22.48,-14.72,;21.14,-17.03,;21.14,-18.57,;19.81,-16.26,;18.27,-17.03,;18.27,-18.57,;16.93,-16.26,;16.93,-14.72,;18.27,-13.95,;18.27,-12.41,;19.6,-14.72,;15.6,-17.03,;14.06,-16.26,;14.06,-14.72,;12.73,-17.03,;12.73,-18.57,;14.06,-19.34,;11.39,-16.26,;9.85,-17.03,;9.85,-18.57,;8.52,-16.26,;7.19,-17.03,;8.52,-14.72,;7.19,-13.95,;7.03,-12.42,;5.52,-12.1,;4.75,-13.43,;5.78,-14.58,;25.35,-14.72,;26.68,-13.95,;24.02,-13.95,;33.76,-14.72,;32.43,-13.95,;35.1,-13.95,;21.86,-7.79,;23.2,-8.56,;20.53,-8.56,;25.35,6.84,;26.68,7.61,;24.02,7.61,;16.32,15.31,;16.32,13.77,;14.78,16.08,;13.45,15.31,;13.45,13.77,;12.12,13,;12.12,11.46,;10.78,13.77,;12.12,16.08,;12.12,17.62,;10.58,15.31,;9.24,16.08,;9.24,17.62,;7.91,18.39,;7.91,19.93,;6.57,17.62,;7.91,15.31,;6.57,16.08,;7.91,13.77,)| Show InChI InChI=1S/C146H236N42O43S/c1-18-75(12)114(141(227)177-96(56-72(6)7)130(216)180-103(144(230)231)62-109(153)198)186-138(224)106(68-191)183-132(218)100(61-108(152)197)175-129(215)95(55-71(4)5)172-131(217)97(58-81-37-41-84(194)42-38-81)173-124(210)88(33-23-26-49-148)165-122(208)89(34-24-27-50-149)169-139(225)112(73(8)9)184-117(203)76(13)162-120(206)93(47-53-232-17)168-126(212)92(45-46-107(151)196)167-121(207)87(32-22-25-48-147)164-123(209)90(35-28-51-159-145(154)155)166-128(214)94(54-70(2)3)171-125(211)91(36-29-52-160-146(156)157)170-142(228)115(78(15)192)187-134(220)98(59-82-39-43-85(195)44-40-82)174-137(223)105(67-190)182-133(219)102(64-111(201)202)179-143(229)116(79(16)193)188-135(221)99(57-80-30-20-19-21-31-80)178-140(226)113(74(10)11)185-118(204)77(14)163-127(213)101(63-110(199)200)176-136(222)104(66-189)181-119(205)86(150)60-83-65-158-69-161-83/h19-21,30-31,37-44,65,69-79,86-106,112-116,189-195H,18,22-29,32-36,45-64,66-68,147-150H2,1-17H3,(H2,151,196)(H2,152,197)(H2,153,198)(H,158,161)(H,162,206)(H,163,213)(H,164,209)(H,165,208)(H,166,214)(H,167,207)(H,168,212)(H,169,225)(H,170,228)(H,171,211)(H,172,217)(H,173,210)(H,174,223)(H,175,215)(H,176,222)(H,177,227)(H,178,226)(H,179,229)(H,180,216)(H,181,205)(H,182,219)(H,183,218)(H,184,203)(H,185,204)(H,186,224)(H,187,220)(H,188,221)(H,199,200)(H,201,202)(H,230,231)(H4,154,155,159)(H4,156,157,160) | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 195: 535-41 (1991) Article DOI: 10.1111/j.1432-1033.1991.tb15734.x BindingDB Entry DOI: 10.7270/Q2RV0M66 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| VIP peptides (RAT) | BDBM82357 ([Tyr13]VIP) Show SMILES CCC(C)C(NC(=O)C(CO)NC(=O)C(CC(N)=O)NC(=O)C(CC(C)C)NC(=O)C(Cc1ccc(O)cc1)NC(=O)C(CCCCN)NC(=O)C(CCCCN)NC(=O)C(NC(=O)C(C)NC(=O)C(CCSC)NC(=O)C(CCC(N)=O)NC(=O)C(CCCCN)NC(=O)C(CCCN=C(N)N)NC(=O)C(CCc1ccc(O)cc1)NC(=O)C(CCCN=C(N)N)NC(=O)C(NC(=O)C(Cc1ccc(O)cc1)NC(=O)C(CC(O)=O)NC(=O)C(CC(O)=O)NC(=O)C(NC(=O)C(Cc1ccccc1)NC(=O)C(NC(=O)C(C)NC(=O)C(CC(O)=O)NC(=O)C(CO)NC(=O)C(N)Cc1cnc[nH]1)C(C)C)C(C)O)C(C)O)C(C)C)C(=O)NC(CC(C)C)C(=O)NC(CC(N)=O)C(O)=O |(16.32,19.93,;16.32,18.39,;17.66,17.62,;18.99,18.39,;17.66,16.08,;18.99,15.31,;20.53,16.08,;20.53,17.62,;21.86,15.31,;21.86,13.77,;20.53,13,;23.2,16.08,;24.74,15.31,;24.74,13.77,;26.07,16.08,;26.07,17.62,;24.74,18.39,;24.74,19.93,;23.4,17.62,;27.41,15.31,;28.95,16.08,;28.95,17.62,;30.28,15.31,;30.28,13.77,;28.95,13,;28.95,11.46,;27.61,13.77,;31.61,16.08,;33.15,15.31,;33.15,13.77,;34.49,16.08,;34.49,17.62,;35.82,18.39,;37.15,17.62,;38.49,18.39,;38.49,19.93,;39.82,20.7,;37.15,20.7,;35.82,19.93,;35.82,15.31,;35.1,4.53,;35.1,2.99,;33.76,5.3,;33.76,6.84,;35.1,7.61,;36.43,6.84,;37.77,7.61,;39.1,6.84,;32.43,4.53,;30.89,5.3,;30.89,6.84,;29.56,4.53,;29.56,2.99,;30.89,2.22,;30.89,.68,;32.22,-.09,;33.56,.68,;28.22,5.3,;26.68,4.53,;26.68,2.99,;25.35,5.3,;24.02,4.53,;22.48,5.3,;22.48,6.84,;21.14,4.53,;21.14,2.99,;19.81,5.3,;18.27,4.53,;18.27,2.99,;16.93,5.3,;16.93,6.84,;18.27,7.61,;18.27,9.15,;16.93,9.92,;15.6,4.53,;14.06,5.3,;14.06,6.84,;12.73,4.53,;12.73,2.99,;14.06,2.22,;14.06,.68,;12.73,-.09,;15.39,-.09,;11.39,5.3,;9.85,4.53,;9.85,2.99,;8.52,5.3,;8.52,6.84,;7.19,7.61,;7.19,9.15,;5.85,9.92,;4.52,9.15,;7.19,4.53,;7.91,-6.25,;7.91,-7.79,;9.24,-5.48,;9.24,-3.94,;7.91,-3.17,;7.91,-1.63,;6.57,-.86,;5.24,-1.63,;3.91,-.86,;5.24,-3.17,;10.58,-6.25,;12.12,-5.48,;12.12,-3.94,;13.45,-6.25,;13.45,-7.79,;12.12,-8.56,;12.03,-9.99,;10.69,-10.76,;10.69,-12.3,;12.03,-13.07,;12.03,-14.13,;13.36,-12.3,;13.36,-10.76,;14.78,-5.48,;16.32,-6.25,;16.32,-7.79,;17.66,-5.48,;17.66,-3.94,;16.32,-3.17,;16.32,-1.63,;17.66,-.86,;17.66,.68,;18.99,1.45,;16.32,1.45,;18.99,-6.25,;20.53,-5.48,;20.53,-3.94,;21.86,-6.25,;23.2,-5.48,;24.74,-6.25,;24.74,-7.79,;26.07,-5.48,;26.07,-3.94,;24.74,-3.17,;24.74,-1.63,;23.4,-.86,;22.07,-1.63,;20.74,-.86,;22.07,-3.17,;23.4,-3.94,;27.41,-6.25,;28.95,-5.48,;28.95,-3.94,;30.28,-6.25,;30.28,-7.79,;28.95,-8.56,;28.95,-10.1,;27.61,-7.79,;31.61,-5.48,;33.15,-6.25,;33.15,-7.79,;34.49,-5.48,;34.49,-3.94,;35.82,-3.17,;35.82,-1.63,;37.15,-3.94,;35.82,-6.25,;35.1,-17.03,;35.1,-18.57,;33.76,-16.26,;32.43,-17.03,;30.89,-16.26,;30.89,-14.72,;29.56,-17.03,;29.56,-18.57,;30.89,-19.34,;30.89,-20.88,;32.22,-21.65,;33.56,-20.88,;33.56,-19.34,;32.22,-18.57,;28.22,-16.26,;26.68,-17.03,;26.68,-18.57,;25.35,-16.26,;24.02,-17.03,;22.48,-16.26,;22.48,-14.72,;21.14,-17.03,;21.14,-18.57,;19.81,-16.26,;18.27,-17.03,;18.27,-18.57,;16.93,-16.26,;16.93,-14.72,;18.27,-13.95,;18.27,-12.41,;19.6,-14.72,;15.6,-17.03,;14.06,-16.26,;14.06,-14.72,;12.73,-17.03,;12.73,-18.57,;14.06,-19.34,;11.39,-16.26,;9.85,-17.03,;9.85,-18.57,;8.52,-16.26,;7.19,-17.03,;8.52,-14.72,;7.19,-13.95,;7.03,-12.42,;5.52,-12.1,;4.75,-13.43,;5.78,-14.58,;25.35,-14.72,;26.68,-13.95,;24.02,-13.95,;33.76,-14.72,;32.43,-13.95,;35.1,-13.95,;21.86,-7.79,;23.2,-8.56,;20.53,-8.56,;25.35,6.84,;26.68,7.61,;24.02,7.61,;16.32,15.31,;16.32,13.77,;14.78,16.08,;13.45,15.31,;13.45,13.77,;12.12,13,;12.12,11.46,;10.78,13.77,;12.12,16.08,;12.12,17.62,;10.58,15.31,;9.24,16.08,;9.24,17.62,;7.91,18.39,;7.91,19.93,;6.57,17.62,;7.91,15.31,;6.57,16.08,;7.91,13.77,)| Show InChI InChI=1S/C151H237N42O46S/c1-16-77(10)119(146(233)183-100(59-74(4)5)135(222)186-108(149(236)237)65-113(158)203)191-143(230)110(71-195)188-137(224)104(64-112(157)202)180-134(221)99(58-73(2)3)177-136(223)101(61-84-37-44-88(199)45-38-84)178-130(217)92(31-21-24-53-153)170-127(214)93(32-22-25-54-154)175-144(231)117(75(6)7)189-122(209)78(11)167-125(212)98(51-57-240-15)174-132(219)97(49-50-111(156)201)173-126(213)91(30-20-23-52-152)169-128(215)94(33-26-55-164-150(159)160)171-131(218)96(48-41-82-35-42-87(198)43-36-82)172-129(216)95(34-27-56-165-151(161)162)176-147(234)120(80(13)196)192-140(227)102(62-85-39-46-89(200)47-40-85)179-139(226)107(68-116(208)239-238)182-138(225)106(67-115(206)207)185-148(235)121(81(14)197)193-141(228)103(60-83-28-18-17-19-29-83)184-145(232)118(76(8)9)190-123(210)79(12)168-133(220)105(66-114(204)205)181-142(229)109(70-194)187-124(211)90(155)63-86-69-163-72-166-86/h17-19,28-29,35-40,42-47,69,72-81,90-110,117-121,194-200,238-239H,16,20-27,30-34,41,48-68,70-71,152-155H2,1-15H3,(H2,156,201)(H2,157,202)(H2,158,203)(H,163,166)(H,167,212)(H,168,220)(H,169,215)(H,170,214)(H,171,218)(H,172,216)(H,173,213)(H,174,219)(H,175,231)(H,176,234)(H,177,223)(H,178,217)(H,179,226)(H,180,221)(H,181,229)(H,182,225)(H,183,233)(H,184,232)(H,185,235)(H,186,222)(H,187,211)(H,188,224)(H,189,209)(H,190,210)(H,191,230)(H,192,227)(H,193,228)(H,204,205)(H,206,207)(H,236,237)(H4,159,160,164)(H4,161,162,165) | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 195: 535-41 (1991) Article DOI: 10.1111/j.1432-1033.1991.tb15734.x BindingDB Entry DOI: 10.7270/Q2RV0M66 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| VIP peptides (RAT) | BDBM82356 (PACAP(2-38)) Show SMILES [#6]-[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#16]-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](-[#7])=O |r| Show InChI InChI=1S/C197H324N60O52S/c1-18-106(12)157(253-151(270)97-223-165(281)143(94-152(271)272)241-163(279)120(205)98-258)192(308)249-141(88-111-40-20-19-21-41-111)186(302)257-158(110(16)261)193(309)250-144(95-153(273)274)185(301)252-146(100-260)188(304)246-140(92-115-59-67-119(265)68-60-115)183(299)251-145(99-259)187(303)235-130(51-38-83-220-196(214)215)175(291)244-138(90-113-55-63-117(263)64-56-113)181(297)234-128(49-36-81-218-194(210)211)171(287)229-123(44-24-31-76-200)168(284)237-133(70-72-148(207)267)177(293)238-134(73-85-310-17)166(282)225-109(15)162(278)254-154(103(6)7)189(305)239-126(47-27-34-79-203)170(286)230-125(46-26-33-78-202)172(288)245-139(91-114-57-65-118(264)66-58-114)182(298)242-136(87-102(4)5)179(295)226-107(13)160(276)224-108(14)161(277)255-155(104(8)9)191(307)248-135(86-101(2)3)164(280)222-96-150(269)227-122(43-23-30-75-199)167(283)231-129(50-37-82-219-195(212)213)174(290)243-137(89-112-53-61-116(262)62-54-112)180(296)233-124(45-25-32-77-201)169(285)236-132(69-71-147(206)266)176(292)232-131(52-39-84-221-197(216)217)178(294)256-156(105(10)11)190(306)240-127(48-28-35-80-204)173(289)247-142(93-149(208)268)184(300)228-121(159(209)275)42-22-29-74-198/h19-21,40-41,53-68,101-110,120-146,154-158,258-265H,18,22-39,42-52,69-100,198-205H2,1-17H3,(H2,206,266)(H2,207,267)(H2,208,268)(H2,209,275)(H,222,280)(H,223,281)(H,224,276)(H,225,282)(H,226,295)(H,227,269)(H,228,300)(H,229,287)(H,230,286)(H,231,283)(H,232,292)(H,233,296)(H,234,297)(H,235,303)(H,236,285)(H,237,284)(H,238,293)(H,239,305)(H,240,306)(H,241,279)(H,242,298)(H,243,290)(H,244,291)(H,245,288)(H,246,304)(H,247,289)(H,248,307)(H,249,308)(H,250,309)(H,251,299)(H,252,301)(H,253,270)(H,254,278)(H,255,277)(H,256,294)(H,257,302)(H,271,272)(H,273,274)(H4,210,211,218)(H4,212,213,219)(H4,214,215,220)(H4,216,217,221)/t106?,107-,108-,109-,110+,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,142-,143-,144-,145-,146-,154-,155-,156-,157-,158-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 195: 535-41 (1991) Article DOI: 10.1111/j.1432-1033.1991.tb15734.x BindingDB Entry DOI: 10.7270/Q2RV0M66 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (RAT) | BDBM81531 ([D-Phe2]PACAP-38 | [DPhe2]PACAP(1-38)) Show SMILES CCC(C)[C@H](NC(=O)CNC(=O)[C@H](CC(O)=O)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(N)=O |r| Show InChI InChI=1S/C209H335N63O52S/c1-18-114(12)168(268-162(284)105-236-176(295)154(101-163(285)286)262-193(312)147(93-119-43-21-19-22-44-119)255-174(293)130(217)99-125-103-230-108-237-125)204(323)264-152(94-120-45-23-20-24-46-120)198(317)272-169(118(16)275)205(324)265-155(102-164(287)288)197(316)267-157(107-274)200(319)260-151(98-124-64-72-129(279)73-65-124)195(314)266-156(106-273)199(318)249-140(56-41-88-233-208(226)227)186(305)258-149(96-122-60-68-127(277)69-61-122)192(311)248-138(54-39-86-231-206(222)223)182(301)243-133(49-27-34-81-212)179(298)251-143(75-77-159(219)281)188(307)252-144(78-90-325-17)177(296)239-117(15)173(292)269-165(111(6)7)201(320)253-136(52-30-37-84-215)181(300)244-135(51-29-36-83-214)183(302)259-150(97-123-62-70-128(278)71-63-123)194(313)256-146(92-110(4)5)190(309)240-115(13)171(290)238-116(14)172(291)270-166(112(8)9)203(322)263-145(91-109(2)3)175(294)235-104-161(283)241-132(48-26-33-80-211)178(297)245-139(55-40-87-232-207(224)225)185(304)257-148(95-121-58-66-126(276)67-59-121)191(310)247-134(50-28-35-82-213)180(299)250-142(74-76-158(218)280)187(306)246-141(57-42-89-234-209(228)229)189(308)271-167(113(10)11)202(321)254-137(53-31-38-85-216)184(303)261-153(100-160(220)282)196(315)242-131(170(221)289)47-25-32-79-210/h19-24,43-46,58-73,103,108-118,130-157,165-169,273-279H,18,25-42,47-57,74-102,104-107,210-217H2,1-17H3,(H2,218,280)(H2,219,281)(H2,220,282)(H2,221,289)(H,230,237)(H,235,294)(H,236,295)(H,238,290)(H,239,296)(H,240,309)(H,241,283)(H,242,315)(H,243,301)(H,244,300)(H,245,297)(H,246,306)(H,247,310)(H,248,311)(H,249,318)(H,250,299)(H,251,298)(H,252,307)(H,253,320)(H,254,321)(H,255,293)(H,256,313)(H,257,304)(H,258,305)(H,259,302)(H,260,319)(H,261,303)(H,262,312)(H,263,322)(H,264,323)(H,265,324)(H,266,314)(H,267,316)(H,268,284)(H,269,292)(H,270,291)(H,271,308)(H,272,317)(H,285,286)(H,287,288)(H4,222,223,231)(H4,224,225,232)(H4,226,227,233)(H4,228,229,234)/t114?,115-,116-,117-,118+,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,142-,143-,144-,145-,146-,147+,148-,149-,150-,151-,152-,153-,154-,155-,156-,157-,165-,166-,167-,168-,169-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PubMed | 5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit´ Libre de Bruxelles Curated by PDSP Ki Database | Mol Pharmacol 42: 347-55 (1992) BindingDB Entry DOI: 10.7270/Q2NZ864G | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (Homo sapiens (Human)) | BDBM81536 (PACAP(5-38)) Show SMILES [#6]-[#6]-[#6](-[#6])-[#6@H](-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#16]-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](-[#7])=O |r| Show InChI InChI=1S/C188H311N57O46S/c1-18-103(12)147(199)180(287)237-137(88-108-40-20-19-21-41-108)177(284)245-151(107(16)248)184(291)239-139(94-146(257)258)176(283)241-141(97-247)179(286)235-136(92-112-59-67-116(252)68-60-112)174(281)240-140(96-246)178(285)225-126(51-38-83-211-187(205)206)166(273)233-134(90-110-55-63-114(250)64-56-110)172(279)224-124(49-36-81-209-185(201)202)162(269)219-119(44-24-31-76-191)159(266)227-129(70-72-143(197)254)168(275)228-130(73-85-292-17)157(264)215-106(15)155(262)242-148(100(6)7)181(288)229-122(47-27-34-79-194)161(268)220-121(46-26-33-78-193)163(270)234-135(91-111-57-65-115(251)66-58-111)173(280)231-132(87-99(4)5)170(277)216-104(13)153(260)214-105(14)154(261)243-149(101(8)9)183(290)238-131(86-98(2)3)156(263)213-95-145(256)217-118(43-23-30-75-190)158(265)221-125(50-37-82-210-186(203)204)165(272)232-133(89-109-53-61-113(249)62-54-109)171(278)223-120(45-25-32-77-192)160(267)226-128(69-71-142(196)253)167(274)222-127(52-39-84-212-188(207)208)169(276)244-150(102(10)11)182(289)230-123(48-28-35-80-195)164(271)236-138(93-144(198)255)175(282)218-117(152(200)259)42-22-29-74-189/h19-21,40-41,53-68,98-107,117-141,147-151,246-252H,18,22-39,42-52,69-97,189-195,199H2,1-17H3,(H2,196,253)(H2,197,254)(H2,198,255)(H2,200,259)(H,213,263)(H,214,260)(H,215,264)(H,216,277)(H,217,256)(H,218,282)(H,219,269)(H,220,268)(H,221,265)(H,222,274)(H,223,278)(H,224,279)(H,225,285)(H,226,267)(H,227,266)(H,228,275)(H,229,288)(H,230,289)(H,231,280)(H,232,272)(H,233,273)(H,234,270)(H,235,286)(H,236,271)(H,237,287)(H,238,290)(H,239,291)(H,240,281)(H,241,283)(H,242,262)(H,243,261)(H,244,276)(H,245,284)(H,257,258)(H4,201,202,209)(H4,203,204,210)(H4,205,206,211)(H4,207,208,212)/t103?,104-,105-,106-,107+,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,147-,148-,149-,150-,151-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 207: 239-46 (1992) Article DOI: 10.1111/j.1432-1033.1992.tb17043.x BindingDB Entry DOI: 10.7270/Q2WM1BW2 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (Homo sapiens (Human)) | BDBM81536 (PACAP(5-38)) Show SMILES [#6]-[#6]-[#6](-[#6])-[#6@H](-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#16]-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](-[#7])=O |r| Show InChI InChI=1S/C188H311N57O46S/c1-18-103(12)147(199)180(287)237-137(88-108-40-20-19-21-41-108)177(284)245-151(107(16)248)184(291)239-139(94-146(257)258)176(283)241-141(97-247)179(286)235-136(92-112-59-67-116(252)68-60-112)174(281)240-140(96-246)178(285)225-126(51-38-83-211-187(205)206)166(273)233-134(90-110-55-63-114(250)64-56-110)172(279)224-124(49-36-81-209-185(201)202)162(269)219-119(44-24-31-76-191)159(266)227-129(70-72-143(197)254)168(275)228-130(73-85-292-17)157(264)215-106(15)155(262)242-148(100(6)7)181(288)229-122(47-27-34-79-194)161(268)220-121(46-26-33-78-193)163(270)234-135(91-111-57-65-115(251)66-58-111)173(280)231-132(87-99(4)5)170(277)216-104(13)153(260)214-105(14)154(261)243-149(101(8)9)183(290)238-131(86-98(2)3)156(263)213-95-145(256)217-118(43-23-30-75-190)158(265)221-125(50-37-82-210-186(203)204)165(272)232-133(89-109-53-61-113(249)62-54-109)171(278)223-120(45-25-32-77-192)160(267)226-128(69-71-142(196)253)167(274)222-127(52-39-84-212-188(207)208)169(276)244-150(102(10)11)182(289)230-123(48-28-35-80-195)164(271)236-138(93-144(198)255)175(282)218-117(152(200)259)42-22-29-74-189/h19-21,40-41,53-68,98-107,117-141,147-151,246-252H,18,22-39,42-52,69-97,189-195,199H2,1-17H3,(H2,196,253)(H2,197,254)(H2,198,255)(H2,200,259)(H,213,263)(H,214,260)(H,215,264)(H,216,277)(H,217,256)(H,218,282)(H,219,269)(H,220,268)(H,221,265)(H,222,274)(H,223,278)(H,224,279)(H,225,285)(H,226,267)(H,227,266)(H,228,275)(H,229,288)(H,230,289)(H,231,280)(H,232,272)(H,233,273)(H,234,270)(H,235,286)(H,236,271)(H,237,287)(H,238,290)(H,239,291)(H,240,281)(H,241,283)(H,242,262)(H,243,261)(H,244,276)(H,245,284)(H,257,258)(H4,201,202,209)(H4,203,204,210)(H4,205,206,211)(H4,207,208,212)/t103?,104-,105-,106-,107+,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,147-,148-,149-,150-,151-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 208: 815-9 (1992) Article DOI: 10.1111/j.1432-1033.1992.tb17252.x BindingDB Entry DOI: 10.7270/Q2J67FD2 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (Homo sapiens (Human)) | BDBM81534 (PACAP(4-38)) Show SMILES [#6]-[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#16]-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](-[#7])=O |r| Show InChI InChI=1S/C190H314N58O47S/c1-18-104(12)152(244-146(259)95-198)185(294)240-138(88-109-40-20-19-21-41-109)179(288)248-153(108(16)251)186(295)241-140(94-148(261)262)178(287)243-142(98-250)181(290)237-137(92-113-59-67-117(255)68-60-113)176(285)242-141(97-249)180(289)227-127(51-38-83-213-189(207)208)168(277)235-135(90-111-55-63-115(253)64-56-111)174(283)226-125(49-36-81-211-187(203)204)164(273)221-120(44-24-31-76-193)161(270)229-130(70-72-144(200)257)170(279)230-131(73-85-296-17)159(268)217-107(15)157(266)245-149(101(6)7)182(291)231-123(47-27-34-79-196)163(272)222-122(46-26-33-78-195)165(274)236-136(91-112-57-65-116(254)66-58-112)175(284)233-133(87-100(4)5)172(281)218-105(13)155(264)216-106(14)156(265)246-150(102(8)9)184(293)239-132(86-99(2)3)158(267)215-96-147(260)219-119(43-23-30-75-192)160(269)223-126(50-37-82-212-188(205)206)167(276)234-134(89-110-53-61-114(252)62-54-110)173(282)225-121(45-25-32-77-194)162(271)228-129(69-71-143(199)256)169(278)224-128(52-39-84-214-190(209)210)171(280)247-151(103(10)11)183(292)232-124(48-28-35-80-197)166(275)238-139(93-145(201)258)177(286)220-118(154(202)263)42-22-29-74-191/h19-21,40-41,53-68,99-108,118-142,149-153,249-255H,18,22-39,42-52,69-98,191-198H2,1-17H3,(H2,199,256)(H2,200,257)(H2,201,258)(H2,202,263)(H,215,267)(H,216,264)(H,217,268)(H,218,281)(H,219,260)(H,220,286)(H,221,273)(H,222,272)(H,223,269)(H,224,278)(H,225,282)(H,226,283)(H,227,289)(H,228,271)(H,229,270)(H,230,279)(H,231,291)(H,232,292)(H,233,284)(H,234,276)(H,235,277)(H,236,274)(H,237,290)(H,238,275)(H,239,293)(H,240,294)(H,241,295)(H,242,285)(H,243,287)(H,244,259)(H,245,266)(H,246,265)(H,247,280)(H,248,288)(H,261,262)(H4,203,204,211)(H4,205,206,212)(H4,207,208,213)(H4,209,210,214)/t104?,105-,106-,107-,108+,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,142-,149-,150-,151-,152-,153-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 208: 815-9 (1992) Article DOI: 10.1111/j.1432-1033.1992.tb17252.x BindingDB Entry DOI: 10.7270/Q2J67FD2 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (Homo sapiens (Human)) | BDBM81534 (PACAP(4-38)) Show SMILES [#6]-[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#16]-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](-[#7])=O |r| Show InChI InChI=1S/C190H314N58O47S/c1-18-104(12)152(244-146(259)95-198)185(294)240-138(88-109-40-20-19-21-41-109)179(288)248-153(108(16)251)186(295)241-140(94-148(261)262)178(287)243-142(98-250)181(290)237-137(92-113-59-67-117(255)68-60-113)176(285)242-141(97-249)180(289)227-127(51-38-83-213-189(207)208)168(277)235-135(90-111-55-63-115(253)64-56-111)174(283)226-125(49-36-81-211-187(203)204)164(273)221-120(44-24-31-76-193)161(270)229-130(70-72-144(200)257)170(279)230-131(73-85-296-17)159(268)217-107(15)157(266)245-149(101(6)7)182(291)231-123(47-27-34-79-196)163(272)222-122(46-26-33-78-195)165(274)236-136(91-112-57-65-116(254)66-58-112)175(284)233-133(87-100(4)5)172(281)218-105(13)155(264)216-106(14)156(265)246-150(102(8)9)184(293)239-132(86-99(2)3)158(267)215-96-147(260)219-119(43-23-30-75-192)160(269)223-126(50-37-82-212-188(205)206)167(276)234-134(89-110-53-61-114(252)62-54-110)173(282)225-121(45-25-32-77-194)162(271)228-129(69-71-143(199)256)169(278)224-128(52-39-84-214-190(209)210)171(280)247-151(103(10)11)183(292)232-124(48-28-35-80-197)166(275)238-139(93-145(201)258)177(286)220-118(154(202)263)42-22-29-74-191/h19-21,40-41,53-68,99-108,118-142,149-153,249-255H,18,22-39,42-52,69-98,191-198H2,1-17H3,(H2,199,256)(H2,200,257)(H2,201,258)(H2,202,263)(H,215,267)(H,216,264)(H,217,268)(H,218,281)(H,219,260)(H,220,286)(H,221,273)(H,222,272)(H,223,269)(H,224,278)(H,225,282)(H,226,283)(H,227,289)(H,228,271)(H,229,270)(H,230,279)(H,231,291)(H,232,292)(H,233,284)(H,234,276)(H,235,277)(H,236,274)(H,237,290)(H,238,275)(H,239,293)(H,240,294)(H,241,295)(H,242,285)(H,243,287)(H,244,259)(H,245,266)(H,246,265)(H,247,280)(H,248,288)(H,261,262)(H4,203,204,211)(H4,205,206,212)(H4,207,208,213)(H4,209,210,214)/t104?,105-,106-,107-,108+,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,142-,149-,150-,151-,152-,153-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 207: 239-46 (1992) Article DOI: 10.1111/j.1432-1033.1992.tb17043.x BindingDB Entry DOI: 10.7270/Q2WM1BW2 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| VIP peptides (RAT) | BDBM82358 (PACAP-VIP) Show SMILES CCC(C)C(NC(=O)CNC(=O)C(CC(O)=O)NC(=O)C(CO)NC(=O)C(N)Cc1cnc[nH]1)C(=O)NC(Cc1ccccc1)C(=O)NC(C(C)O)C(=O)NC(CC(O)=O)C(=O)NC(CO)C(=O)NC(Cc1ccc(O)cc1)C(=O)NC(C(C)O)C(=O)NC(CCCN=C(N)N)C(=O)NC(CC(C)C)C(=O)NC(CCCN=C(N)N)C(=O)NC(CCCCN)C(=O)NC(CCC(N)=O)C(=O)NC(CCSC)C(=O)NC(C)C(=O)NC(C(C)C)C(=O)NC(CCCCN)C(=O)NC(CCCCN)C(=O)NC(Cc1ccc(O)cc1)C(=O)NC(CC(C)C)C(=O)NC(CC(N)=O)C(=O)NC(CO)C(=O)NC(C(C)CC)C(=O)NC(CC(C)C)C(=O)NC(CC(N)=O)C(O)=O |(25.91,-12.62,;26.68,-13.95,;25.35,-14.72,;24.02,-13.95,;25.35,-16.26,;24.02,-17.03,;22.48,-16.26,;22.48,-14.72,;21.14,-17.03,;19.81,-16.26,;18.27,-17.03,;18.27,-18.57,;16.93,-16.26,;16.93,-14.72,;18.27,-13.95,;18.27,-12.41,;19.6,-14.72,;15.6,-17.03,;14.06,-16.26,;14.06,-14.72,;12.73,-17.03,;12.73,-18.57,;14.06,-19.34,;11.39,-16.26,;9.85,-17.03,;9.85,-18.57,;8.52,-16.26,;7.19,-17.03,;8.52,-14.72,;7.19,-13.95,;7.03,-12.42,;5.52,-12.1,;4.75,-13.43,;5.78,-14.58,;26.68,-17.03,;26.68,-18.57,;28.22,-16.26,;29.56,-17.03,;29.56,-18.57,;30.89,-19.34,;30.89,-20.88,;32.22,-21.65,;33.56,-20.88,;33.56,-19.34,;32.22,-18.57,;30.89,-16.26,;30.89,-14.72,;32.43,-17.03,;33.76,-16.26,;33.76,-14.72,;32.43,-13.95,;35.1,-13.95,;35.1,-17.03,;35.1,-18.57,;35.82,-6.25,;34.49,-5.48,;34.49,-3.94,;35.82,-3.17,;35.82,-1.63,;37.15,-3.94,;33.15,-6.25,;33.15,-7.79,;31.61,-5.48,;30.28,-6.25,;30.28,-7.79,;28.95,-8.56,;28.95,-5.48,;28.95,-3.94,;27.41,-6.25,;26.07,-5.48,;26.07,-3.94,;24.74,-3.17,;24.74,-1.63,;23.4,-.86,;22.07,-1.63,;20.74,-.86,;22.07,-3.17,;23.4,-3.94,;24.74,-6.25,;24.74,-7.79,;23.2,-5.48,;21.86,-6.25,;21.86,-7.79,;23.2,-8.56,;20.53,-8.56,;20.53,-5.48,;20.53,-3.94,;18.99,-6.25,;17.66,-5.48,;17.66,-3.94,;16.32,-3.17,;16.32,-1.63,;17.66,-.86,;17.66,.68,;18.99,1.45,;16.32,1.45,;16.32,-6.25,;16.32,-7.79,;14.78,-5.48,;13.45,-6.25,;13.45,-7.79,;12.12,-8.56,;12.12,-10.1,;10.78,-7.79,;12.12,-5.48,;12.12,-3.94,;10.58,-6.25,;9.24,-5.48,;9.24,-3.94,;7.91,-3.17,;7.91,-1.63,;6.57,-.86,;5.24,-1.63,;3.91,-.86,;5.24,-3.17,;7.91,-6.25,;7.91,-7.79,;7.19,4.53,;8.52,5.3,;8.52,6.84,;7.19,7.61,;7.19,9.15,;5.85,9.92,;4.52,9.15,;9.85,4.53,;9.85,2.99,;11.39,5.3,;12.73,4.53,;12.73,2.99,;14.06,2.22,;14.06,.68,;12.73,-.09,;15.39,-.09,;14.06,5.3,;14.06,6.84,;15.6,4.53,;16.93,5.3,;16.93,6.84,;18.27,7.61,;18.27,9.15,;16.93,9.92,;18.27,4.53,;18.27,2.99,;19.81,5.3,;21.14,4.53,;21.14,2.99,;22.48,5.3,;22.48,6.84,;24.02,4.53,;25.35,5.3,;25.35,6.84,;26.68,7.61,;24.02,7.61,;26.68,4.53,;26.68,2.99,;28.22,5.3,;29.56,4.53,;29.56,2.99,;30.89,2.22,;30.89,.68,;32.22,-.09,;33.56,.68,;30.89,5.3,;30.89,6.84,;32.43,4.53,;33.76,5.3,;33.76,6.84,;35.1,7.61,;36.43,6.84,;37.77,7.61,;39.1,6.84,;35.1,4.53,;35.1,2.99,;35.82,15.31,;34.49,16.08,;34.49,17.62,;35.82,18.39,;37.15,17.62,;38.49,18.39,;38.49,19.93,;39.82,20.7,;37.15,20.7,;35.82,19.93,;33.15,15.31,;33.15,13.77,;31.61,16.08,;30.28,15.31,;30.28,13.77,;28.95,13,;28.95,11.46,;27.61,13.77,;28.95,16.08,;28.95,17.62,;27.41,15.31,;26.07,16.08,;26.07,17.62,;24.74,18.39,;24.74,19.93,;23.4,17.62,;24.74,15.31,;24.74,13.77,;23.2,16.08,;21.86,15.31,;21.86,13.77,;20.53,13,;20.53,16.08,;20.53,17.62,;18.99,15.31,;17.66,16.08,;17.66,17.62,;18.99,18.39,;16.32,18.39,;16.32,19.93,;16.32,15.31,;16.32,13.77,;14.78,16.08,;13.45,15.31,;13.45,13.77,;12.12,13,;12.12,11.46,;10.78,13.77,;12.12,16.08,;12.12,17.62,;10.58,15.31,;9.24,16.08,;9.24,17.62,;7.91,18.39,;7.91,19.93,;6.57,17.62,;7.91,15.31,;6.57,16.08,;7.91,13.77,)| Show InChI InChI=1S/C146H236N42O43S/c1-17-75(11)114(184-110(199)66-161-120(206)101(63-111(200)201)176-136(222)104(67-189)181-119(205)86(150)60-83-65-158-70-162-83)140(226)178-99(57-80-30-20-19-21-31-80)135(221)188-117(79(15)193)143(229)179-102(64-112(202)203)133(219)182-105(68-190)137(223)174-98(59-82-39-43-85(195)44-40-82)134(220)187-116(78(14)192)142(228)170-91(36-29-52-160-146(156)157)126(212)171-94(54-71(3)4)128(214)166-90(35-28-51-159-145(154)155)124(210)164-87(32-22-25-48-147)122(208)167-92(45-46-107(151)196)127(213)168-93(47-53-232-16)121(207)163-77(13)118(204)185-113(74(9)10)139(225)169-89(34-24-27-50-149)123(209)165-88(33-23-26-49-148)125(211)173-97(58-81-37-41-84(194)42-38-81)131(217)172-95(55-72(5)6)129(215)175-100(61-108(152)197)132(218)183-106(69-191)138(224)186-115(76(12)18-2)141(227)177-96(56-73(7)8)130(216)180-103(144(230)231)62-109(153)198/h19-21,30-31,37-44,65,70-79,86-106,113-117,189-195H,17-18,22-29,32-36,45-64,66-69,147-150H2,1-16H3,(H2,151,196)(H2,152,197)(H2,153,198)(H,158,162)(H,161,206)(H,163,207)(H,164,210)(H,165,209)(H,166,214)(H,167,208)(H,168,213)(H,169,225)(H,170,228)(H,171,212)(H,172,217)(H,173,211)(H,174,223)(H,175,215)(H,176,222)(H,177,227)(H,178,226)(H,179,229)(H,180,216)(H,181,205)(H,182,219)(H,183,218)(H,184,199)(H,185,204)(H,186,224)(H,187,220)(H,188,221)(H,200,201)(H,202,203)(H,230,231)(H4,154,155,159)(H4,156,157,160) | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 195: 535-41 (1991) Article DOI: 10.1111/j.1432-1033.1991.tb15734.x BindingDB Entry DOI: 10.7270/Q2RV0M66 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (RAT) | BDBM81535 (CHEMBL525267 | PACAP(6-38)) Show SMILES [#6]-[#16]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-c1ccccc1)-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](-[#7])=O |r| Show InChI InChI=1S/C182H300N56O45S/c1-95(2)83-128(152(257)207-92-141(249)211-115(40-20-27-72-184)154(259)215-122(47-34-79-204-180(197)198)161(266)226-130(86-105-50-58-109(242)59-51-105)167(272)217-117(42-22-29-74-186)156(261)220-125(66-68-138(191)246)163(268)216-124(49-36-81-206-182(201)202)165(270)237-145(99(9)10)176(281)224-120(45-25-32-77-189)160(265)230-134(90-140(193)248)171(276)212-114(147(194)252)39-19-26-71-183)231-177(282)144(98(7)8)236-149(254)101(12)208-148(253)100(11)210-166(271)129(84-96(3)4)225-169(274)132(88-107-54-62-111(244)63-55-107)228-159(264)118(43-23-30-75-187)214-157(262)119(44-24-31-76-188)223-175(280)143(97(5)6)235-150(255)102(13)209-153(258)127(70-82-284-15)222-164(269)126(67-69-139(192)247)221-155(260)116(41-21-28-73-185)213-158(263)121(46-33-78-203-179(195)196)218-168(273)131(87-106-52-60-110(243)61-53-106)227-162(267)123(48-35-80-205-181(199)200)219-173(278)136(93-239)233-170(275)133(89-108-56-64-112(245)65-57-108)229-174(279)137(94-240)234-172(277)135(91-142(250)251)232-178(283)146(103(14)241)238-151(256)113(190)85-104-37-17-16-18-38-104/h16-18,37-38,50-65,95-103,113-137,143-146,239-245H,19-36,39-49,66-94,183-190H2,1-15H3,(H2,191,246)(H2,192,247)(H2,193,248)(H2,194,252)(H,207,257)(H,208,253)(H,209,258)(H,210,271)(H,211,249)(H,212,276)(H,213,263)(H,214,262)(H,215,259)(H,216,268)(H,217,272)(H,218,273)(H,219,278)(H,220,261)(H,221,260)(H,222,269)(H,223,280)(H,224,281)(H,225,274)(H,226,266)(H,227,267)(H,228,264)(H,229,279)(H,230,265)(H,231,282)(H,232,283)(H,233,275)(H,234,277)(H,235,255)(H,236,254)(H,237,270)(H,238,256)(H,250,251)(H4,195,196,203)(H4,197,198,204)(H4,199,200,205)(H4,201,202,206)/t100-,101-,102-,103+,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,143-,144-,145-,146-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 7 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit´ Libre de Bruxelles Curated by PDSP Ki Database | Mol Pharmacol 42: 347-55 (1992) BindingDB Entry DOI: 10.7270/Q2NZ864G | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (RAT) | BDBM81531 ([D-Phe2]PACAP-38 | [DPhe2]PACAP(1-38)) Show SMILES CCC(C)[C@H](NC(=O)CNC(=O)[C@H](CC(O)=O)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(N)=O |r| Show InChI InChI=1S/C209H335N63O52S/c1-18-114(12)168(268-162(284)105-236-176(295)154(101-163(285)286)262-193(312)147(93-119-43-21-19-22-44-119)255-174(293)130(217)99-125-103-230-108-237-125)204(323)264-152(94-120-45-23-20-24-46-120)198(317)272-169(118(16)275)205(324)265-155(102-164(287)288)197(316)267-157(107-274)200(319)260-151(98-124-64-72-129(279)73-65-124)195(314)266-156(106-273)199(318)249-140(56-41-88-233-208(226)227)186(305)258-149(96-122-60-68-127(277)69-61-122)192(311)248-138(54-39-86-231-206(222)223)182(301)243-133(49-27-34-81-212)179(298)251-143(75-77-159(219)281)188(307)252-144(78-90-325-17)177(296)239-117(15)173(292)269-165(111(6)7)201(320)253-136(52-30-37-84-215)181(300)244-135(51-29-36-83-214)183(302)259-150(97-123-62-70-128(278)71-63-123)194(313)256-146(92-110(4)5)190(309)240-115(13)171(290)238-116(14)172(291)270-166(112(8)9)203(322)263-145(91-109(2)3)175(294)235-104-161(283)241-132(48-26-33-80-211)178(297)245-139(55-40-87-232-207(224)225)185(304)257-148(95-121-58-66-126(276)67-59-121)191(310)247-134(50-28-35-82-213)180(299)250-142(74-76-158(218)280)187(306)246-141(57-42-89-234-209(228)229)189(308)271-167(113(10)11)202(321)254-137(53-31-38-85-216)184(303)261-153(100-160(220)282)196(315)242-131(170(221)289)47-25-32-79-210/h19-24,43-46,58-73,103,108-118,130-157,165-169,273-279H,18,25-42,47-57,74-102,104-107,210-217H2,1-17H3,(H2,218,280)(H2,219,281)(H2,220,282)(H2,221,289)(H,230,237)(H,235,294)(H,236,295)(H,238,290)(H,239,296)(H,240,309)(H,241,283)(H,242,315)(H,243,301)(H,244,300)(H,245,297)(H,246,306)(H,247,310)(H,248,311)(H,249,318)(H,250,299)(H,251,298)(H,252,307)(H,253,320)(H,254,321)(H,255,293)(H,256,313)(H,257,304)(H,258,305)(H,259,302)(H,260,319)(H,261,303)(H,262,312)(H,263,322)(H,264,323)(H,265,324)(H,266,314)(H,267,316)(H,268,284)(H,269,292)(H,270,291)(H,271,308)(H,272,317)(H,285,286)(H,287,288)(H4,222,223,231)(H4,224,225,232)(H4,226,227,233)(H4,228,229,234)/t114?,115-,116-,117-,118+,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,142-,143-,144-,145-,146-,147+,148-,149-,150-,151-,152-,153-,154-,155-,156-,157-,165-,166-,167-,168-,169-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 8 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Neuropharmacology 33: 1189-95 (1994) Article DOI: 10.1016/s0028-3908(05)80009-7 BindingDB Entry DOI: 10.7270/Q2251GP3 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (Homo sapiens (Human)) | BDBM81528 (PACAP(7-38)) Show SMILES [#6]-[#16]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](-[#7])=O |r| Show InChI InChI=1S/C173H291N55O44S/c1-89(2)78-120(143(246)198-86-133(239)202-107(35-17-24-67-175)145(248)206-114(42-31-74-195-171(188)189)152(255)217-122(80-98-45-53-102(232)54-46-98)158(261)208-109(37-19-26-69-177)147(250)211-117(61-63-130(181)236)154(257)207-116(44-33-76-197-173(192)193)156(259)228-138(93(9)10)168(271)215-112(40-22-29-72-180)151(254)221-126(84-132(183)238)162(265)203-106(139(185)242)34-16-23-66-174)223-169(272)137(92(7)8)227-141(244)95(12)199-140(243)94(11)201-157(260)121(79-90(3)4)216-160(263)124(82-100-49-57-104(234)58-50-100)219-150(253)110(38-20-27-70-178)205-148(251)111(39-21-28-71-179)214-167(270)136(91(5)6)226-142(245)96(13)200-144(247)119(65-77-273-15)213-155(258)118(62-64-131(182)237)212-146(249)108(36-18-25-68-176)204-149(252)113(41-30-73-194-170(186)187)209-159(262)123(81-99-47-55-103(233)56-48-99)218-153(256)115(43-32-75-196-172(190)191)210-164(267)128(87-229)224-161(264)125(83-101-51-59-105(235)60-52-101)220-165(268)129(88-230)225-163(266)127(85-134(240)241)222-166(269)135(184)97(14)231/h45-60,89-97,106-129,135-138,229-235H,16-44,61-88,174-180,184H2,1-15H3,(H2,181,236)(H2,182,237)(H2,183,238)(H2,185,242)(H,198,246)(H,199,243)(H,200,247)(H,201,260)(H,202,239)(H,203,265)(H,204,252)(H,205,251)(H,206,248)(H,207,257)(H,208,261)(H,209,262)(H,210,267)(H,211,250)(H,212,249)(H,213,258)(H,214,270)(H,215,271)(H,216,263)(H,217,255)(H,218,256)(H,219,253)(H,220,268)(H,221,254)(H,222,269)(H,223,272)(H,224,264)(H,225,266)(H,226,245)(H,227,244)(H,228,259)(H,240,241)(H4,186,187,194)(H4,188,189,195)(H4,190,191,196)(H4,192,193,197)/t94-,95-,96-,97+,106-,107-,108-,109-,110-,111-,112-,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,135-,136-,137-,138-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 8 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 207: 239-46 (1992) Article DOI: 10.1111/j.1432-1033.1992.tb17043.x BindingDB Entry DOI: 10.7270/Q2WM1BW2 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (RAT) | BDBM82441 ([DAla2]PACAP(1-27)) Show SMILES CCC(C)[C@H](NC(=O)CNC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(N)=O |r,wU:48.49,63.64,81.83,98.100,121.124,139.142,152.155,168.171,189.193,202.207,214.218,49.52,4.4,12.17,21.21,26.26,wD:37.37,55.56,69.70,87.89,110.113,147.151,177.180,197.202,207.211,130.133,159.162,(-14.46,-50.6,;-14.44,-52.33,;-15.67,-53.24,;-17,-52.47,;-15.67,-54.78,;-17,-55.55,;-18.34,-54.78,;-18.34,-53.24,;-19.43,-55.87,;-20.76,-55.1,;-22.14,-55.94,;-22.14,-57.48,;-23.47,-55.17,;-23.47,-53.63,;-24.56,-52.54,;-24.56,-51,;-25.89,-50.23,;-23.23,-50.23,;-24.56,-56.25,;-25.89,-55.48,;-25.96,-54.17,;-27.23,-56.25,;-27.23,-57.79,;-28.56,-55.48,;-29.89,-56.25,;-29.89,-57.79,;-31.23,-55.48,;-32.54,-56.66,;-31.23,-53.94,;-32,-52.61,;-32,-51.07,;-34.67,-51.07,;-34.67,-52.61,;-33.33,-53.38,;-14.34,-55.55,;-14.41,-57.12,;-13,-54.78,;-11.67,-55.55,;-11.67,-57.09,;-10.34,-57.86,;-9,-57.09,;-7.66,-57.86,;-7.66,-59.41,;-9,-60.18,;-10.34,-59.41,;-10.34,-54.78,;-10.34,-53.24,;-9,-55.55,;-7.67,-54.78,;-7.67,-53.24,;-9,-52.47,;-6.33,-52.47,;-6.33,-55.55,;-6.33,-57.09,;-5,-54.78,;-3.67,-55.55,;-3.67,-57.09,;-2.33,-57.86,;-1,-57.09,;-2.33,-59.4,;-2.33,-54.78,;-2.33,-53.24,;-1,-55.55,;.33,-54.78,;.33,-53.24,;1.67,-52.47,;1.67,-55.55,;1.67,-57.09,;3,-54.78,;4.34,-55.55,;4.34,-57.09,;5.67,-57.86,;7.01,-57.09,;8.35,-57.86,;8.35,-59.41,;9.68,-60.18,;7.01,-60.18,;5.67,-59.41,;5.67,-54.78,;5.67,-53.24,;7,-55.55,;8.34,-54.78,;8.34,-53.24,;9.67,-52.47,;9.67,-55.55,;9.67,-57.09,;11,-54.78,;12.34,-55.55,;12.34,-57.09,;13.67,-57.86,;13.67,-59.4,;15,-60.17,;15,-61.71,;13.67,-62.48,;16.34,-62.48,;13.67,-54.78,;13.67,-53.24,;15,-55.55,;16.34,-54.78,;16.34,-53.24,;17.67,-52.47,;19.01,-53.25,;20.35,-52.47,;20.35,-50.93,;21.68,-50.16,;19.01,-50.16,;17.67,-50.93,;17.67,-55.55,;17.67,-57.09,;19.01,-54.78,;20.34,-55.55,;20.34,-57.09,;21.67,-57.86,;21.67,-59.4,;23.01,-60.17,;23.01,-61.71,;21.67,-62.48,;24.34,-62.48,;21.67,-54.78,;21.67,-53.24,;23.01,-55.55,;24.34,-54.78,;24.34,-53.24,;25.67,-52.47,;25.67,-50.93,;27.01,-50.16,;27.01,-48.62,;25.67,-55.55,;25.67,-57.09,;27.01,-54.78,;28.34,-55.55,;28.34,-57.09,;29.67,-57.86,;29.67,-59.4,;28.34,-60.17,;31.01,-60.17,;29.67,-54.78,;29.67,-53.24,;31.01,-55.55,;32.34,-54.78,;32.34,-53.24,;33.68,-52.47,;33.68,-50.93,;35.01,-50.16,;33.68,-55.55,;33.68,-57.09,;35.01,-54.78,;36.34,-55.55,;36.34,-57.09,;37.68,-54.78,;37.68,-53.24,;39.01,-55.55,;40.34,-54.78,;40.34,-53.24,;41.68,-52.47,;39.01,-52.47,;41.68,-55.55,;41.68,-57.09,;43.01,-54.78,;44.34,-55.55,;44.34,-57.09,;45.68,-57.86,;45.68,-59.4,;47.01,-60.17,;47.01,-61.71,;45.68,-54.78,;45.68,-53.24,;47.01,-55.55,;48.35,-54.78,;48.35,-53.24,;49.68,-52.47,;49.68,-50.93,;51.01,-50.16,;51.01,-48.62,;49.68,-55.55,;49.68,-57.09,;51.01,-54.78,;52.35,-55.55,;52.35,-57.09,;53.68,-57.86,;55.02,-57.09,;56.36,-57.86,;56.36,-59.41,;57.69,-60.18,;55.02,-60.18,;53.68,-59.41,;53.68,-54.78,;53.68,-53.24,;55.01,-55.55,;56.35,-54.78,;56.35,-53.24,;57.68,-52.47,;57.68,-50.93,;59.01,-53.24,;57.68,-55.55,;57.68,-57.09,;59.01,-54.78,;60.35,-55.55,;60.35,-57.09,;61.68,-54.78,;61.68,-53.24,;63.02,-55.55,;64.35,-54.78,;64.35,-53.24,;65.68,-55.55,;65.68,-57.09,;67.02,-54.78,;68.35,-55.55,;68.35,-57.09,;69.68,-57.86,;67.02,-57.86,;69.68,-54.78,;69.68,-53.24,;71.02,-55.55,;72.35,-54.78,;72.35,-53.24,;73.68,-52.47,;73.68,-50.93,;75.02,-53.24,;73.68,-55.55,;75.02,-54.78,;73.68,-57.09,)| Show InChI InChI=1S/C143H226N40O38S/c1-17-76(10)114(180-109(191)68-157-122(202)96(49-51-110(192)193)163-118(198)78(12)160-121(201)90(147)65-86-67-154-71-158-86)140(220)176-104(61-82-29-19-18-20-30-82)135(215)183-115(81(15)186)141(221)177-105(66-111(194)195)134(214)179-107(70-185)137(217)175-103(64-85-40-46-89(189)47-41-85)133(213)178-106(69-184)136(216)167-95(35-28-57-156-143(152)153)128(208)173-101(62-83-36-42-87(187)43-37-83)131(211)166-94(34-27-56-155-142(150)151)126(206)164-91(31-21-24-53-144)124(204)168-97(48-50-108(148)190)129(209)169-98(52-58-222-16)123(203)161-80(14)120(200)181-112(74(6)7)138(218)170-93(33-23-26-55-146)125(205)165-92(32-22-25-54-145)127(207)174-102(63-84-38-44-88(188)45-39-84)132(212)172-100(60-73(4)5)130(210)162-77(11)117(197)159-79(13)119(199)182-113(75(8)9)139(219)171-99(116(149)196)59-72(2)3/h18-20,29-30,36-47,67,71-81,90-107,112-115,184-189H,17,21-28,31-35,48-66,68-70,144-147H2,1-16H3,(H2,148,190)(H2,149,196)(H,154,158)(H,157,202)(H,159,197)(H,160,201)(H,161,203)(H,162,210)(H,163,198)(H,164,206)(H,165,205)(H,166,211)(H,167,216)(H,168,204)(H,169,209)(H,170,218)(H,171,219)(H,172,212)(H,173,208)(H,174,207)(H,175,217)(H,176,220)(H,177,221)(H,178,213)(H,179,214)(H,180,191)(H,181,200)(H,182,199)(H,183,215)(H,192,193)(H,194,195)(H4,150,151,155)(H4,152,153,156)/t76?,77-,78+,79-,80-,81+,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,112-,113-,114-,115-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 8 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Neuropharmacology 33: 1189-95 (1994) Article DOI: 10.1016/s0028-3908(05)80009-7 BindingDB Entry DOI: 10.7270/Q2251GP3 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (Homo sapiens (Human)) | BDBM81528 (PACAP(7-38)) Show SMILES [#6]-[#16]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](-[#7])=O |r| Show InChI InChI=1S/C173H291N55O44S/c1-89(2)78-120(143(246)198-86-133(239)202-107(35-17-24-67-175)145(248)206-114(42-31-74-195-171(188)189)152(255)217-122(80-98-45-53-102(232)54-46-98)158(261)208-109(37-19-26-69-177)147(250)211-117(61-63-130(181)236)154(257)207-116(44-33-76-197-173(192)193)156(259)228-138(93(9)10)168(271)215-112(40-22-29-72-180)151(254)221-126(84-132(183)238)162(265)203-106(139(185)242)34-16-23-66-174)223-169(272)137(92(7)8)227-141(244)95(12)199-140(243)94(11)201-157(260)121(79-90(3)4)216-160(263)124(82-100-49-57-104(234)58-50-100)219-150(253)110(38-20-27-70-178)205-148(251)111(39-21-28-71-179)214-167(270)136(91(5)6)226-142(245)96(13)200-144(247)119(65-77-273-15)213-155(258)118(62-64-131(182)237)212-146(249)108(36-18-25-68-176)204-149(252)113(41-30-73-194-170(186)187)209-159(262)123(81-99-47-55-103(233)56-48-99)218-153(256)115(43-32-75-196-172(190)191)210-164(267)128(87-229)224-161(264)125(83-101-51-59-105(235)60-52-101)220-165(268)129(88-230)225-163(266)127(85-134(240)241)222-166(269)135(184)97(14)231/h45-60,89-97,106-129,135-138,229-235H,16-44,61-88,174-180,184H2,1-15H3,(H2,181,236)(H2,182,237)(H2,183,238)(H2,185,242)(H,198,246)(H,199,243)(H,200,247)(H,201,260)(H,202,239)(H,203,265)(H,204,252)(H,205,251)(H,206,248)(H,207,257)(H,208,261)(H,209,262)(H,210,267)(H,211,250)(H,212,249)(H,213,258)(H,214,270)(H,215,271)(H,216,263)(H,217,255)(H,218,256)(H,219,253)(H,220,268)(H,221,254)(H,222,269)(H,223,272)(H,224,264)(H,225,266)(H,226,245)(H,227,244)(H,228,259)(H,240,241)(H4,186,187,194)(H4,188,189,195)(H4,190,191,196)(H4,192,193,197)/t94-,95-,96-,97+,106-,107-,108-,109-,110-,111-,112-,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,135-,136-,137-,138-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 8 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 208: 815-9 (1992) Article DOI: 10.1111/j.1432-1033.1992.tb17252.x BindingDB Entry DOI: 10.7270/Q2J67FD2 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| VIP peptides (Homo sapiens (Human)) | BDBM82358 (PACAP-VIP) Show SMILES CCC(C)C(NC(=O)CNC(=O)C(CC(O)=O)NC(=O)C(CO)NC(=O)C(N)Cc1cnc[nH]1)C(=O)NC(Cc1ccccc1)C(=O)NC(C(C)O)C(=O)NC(CC(O)=O)C(=O)NC(CO)C(=O)NC(Cc1ccc(O)cc1)C(=O)NC(C(C)O)C(=O)NC(CCCN=C(N)N)C(=O)NC(CC(C)C)C(=O)NC(CCCN=C(N)N)C(=O)NC(CCCCN)C(=O)NC(CCC(N)=O)C(=O)NC(CCSC)C(=O)NC(C)C(=O)NC(C(C)C)C(=O)NC(CCCCN)C(=O)NC(CCCCN)C(=O)NC(Cc1ccc(O)cc1)C(=O)NC(CC(C)C)C(=O)NC(CC(N)=O)C(=O)NC(CO)C(=O)NC(C(C)CC)C(=O)NC(CC(C)C)C(=O)NC(CC(N)=O)C(O)=O |(25.91,-12.62,;26.68,-13.95,;25.35,-14.72,;24.02,-13.95,;25.35,-16.26,;24.02,-17.03,;22.48,-16.26,;22.48,-14.72,;21.14,-17.03,;19.81,-16.26,;18.27,-17.03,;18.27,-18.57,;16.93,-16.26,;16.93,-14.72,;18.27,-13.95,;18.27,-12.41,;19.6,-14.72,;15.6,-17.03,;14.06,-16.26,;14.06,-14.72,;12.73,-17.03,;12.73,-18.57,;14.06,-19.34,;11.39,-16.26,;9.85,-17.03,;9.85,-18.57,;8.52,-16.26,;7.19,-17.03,;8.52,-14.72,;7.19,-13.95,;7.03,-12.42,;5.52,-12.1,;4.75,-13.43,;5.78,-14.58,;26.68,-17.03,;26.68,-18.57,;28.22,-16.26,;29.56,-17.03,;29.56,-18.57,;30.89,-19.34,;30.89,-20.88,;32.22,-21.65,;33.56,-20.88,;33.56,-19.34,;32.22,-18.57,;30.89,-16.26,;30.89,-14.72,;32.43,-17.03,;33.76,-16.26,;33.76,-14.72,;32.43,-13.95,;35.1,-13.95,;35.1,-17.03,;35.1,-18.57,;35.82,-6.25,;34.49,-5.48,;34.49,-3.94,;35.82,-3.17,;35.82,-1.63,;37.15,-3.94,;33.15,-6.25,;33.15,-7.79,;31.61,-5.48,;30.28,-6.25,;30.28,-7.79,;28.95,-8.56,;28.95,-5.48,;28.95,-3.94,;27.41,-6.25,;26.07,-5.48,;26.07,-3.94,;24.74,-3.17,;24.74,-1.63,;23.4,-.86,;22.07,-1.63,;20.74,-.86,;22.07,-3.17,;23.4,-3.94,;24.74,-6.25,;24.74,-7.79,;23.2,-5.48,;21.86,-6.25,;21.86,-7.79,;23.2,-8.56,;20.53,-8.56,;20.53,-5.48,;20.53,-3.94,;18.99,-6.25,;17.66,-5.48,;17.66,-3.94,;16.32,-3.17,;16.32,-1.63,;17.66,-.86,;17.66,.68,;18.99,1.45,;16.32,1.45,;16.32,-6.25,;16.32,-7.79,;14.78,-5.48,;13.45,-6.25,;13.45,-7.79,;12.12,-8.56,;12.12,-10.1,;10.78,-7.79,;12.12,-5.48,;12.12,-3.94,;10.58,-6.25,;9.24,-5.48,;9.24,-3.94,;7.91,-3.17,;7.91,-1.63,;6.57,-.86,;5.24,-1.63,;3.91,-.86,;5.24,-3.17,;7.91,-6.25,;7.91,-7.79,;7.19,4.53,;8.52,5.3,;8.52,6.84,;7.19,7.61,;7.19,9.15,;5.85,9.92,;4.52,9.15,;9.85,4.53,;9.85,2.99,;11.39,5.3,;12.73,4.53,;12.73,2.99,;14.06,2.22,;14.06,.68,;12.73,-.09,;15.39,-.09,;14.06,5.3,;14.06,6.84,;15.6,4.53,;16.93,5.3,;16.93,6.84,;18.27,7.61,;18.27,9.15,;16.93,9.92,;18.27,4.53,;18.27,2.99,;19.81,5.3,;21.14,4.53,;21.14,2.99,;22.48,5.3,;22.48,6.84,;24.02,4.53,;25.35,5.3,;25.35,6.84,;26.68,7.61,;24.02,7.61,;26.68,4.53,;26.68,2.99,;28.22,5.3,;29.56,4.53,;29.56,2.99,;30.89,2.22,;30.89,.68,;32.22,-.09,;33.56,.68,;30.89,5.3,;30.89,6.84,;32.43,4.53,;33.76,5.3,;33.76,6.84,;35.1,7.61,;36.43,6.84,;37.77,7.61,;39.1,6.84,;35.1,4.53,;35.1,2.99,;35.82,15.31,;34.49,16.08,;34.49,17.62,;35.82,18.39,;37.15,17.62,;38.49,18.39,;38.49,19.93,;39.82,20.7,;37.15,20.7,;35.82,19.93,;33.15,15.31,;33.15,13.77,;31.61,16.08,;30.28,15.31,;30.28,13.77,;28.95,13,;28.95,11.46,;27.61,13.77,;28.95,16.08,;28.95,17.62,;27.41,15.31,;26.07,16.08,;26.07,17.62,;24.74,18.39,;24.74,19.93,;23.4,17.62,;24.74,15.31,;24.74,13.77,;23.2,16.08,;21.86,15.31,;21.86,13.77,;20.53,13,;20.53,16.08,;20.53,17.62,;18.99,15.31,;17.66,16.08,;17.66,17.62,;18.99,18.39,;16.32,18.39,;16.32,19.93,;16.32,15.31,;16.32,13.77,;14.78,16.08,;13.45,15.31,;13.45,13.77,;12.12,13,;12.12,11.46,;10.78,13.77,;12.12,16.08,;12.12,17.62,;10.58,15.31,;9.24,16.08,;9.24,17.62,;7.91,18.39,;7.91,19.93,;6.57,17.62,;7.91,15.31,;6.57,16.08,;7.91,13.77,)| Show InChI InChI=1S/C146H236N42O43S/c1-17-75(11)114(184-110(199)66-161-120(206)101(63-111(200)201)176-136(222)104(67-189)181-119(205)86(150)60-83-65-158-70-162-83)140(226)178-99(57-80-30-20-19-21-31-80)135(221)188-117(79(15)193)143(229)179-102(64-112(202)203)133(219)182-105(68-190)137(223)174-98(59-82-39-43-85(195)44-40-82)134(220)187-116(78(14)192)142(228)170-91(36-29-52-160-146(156)157)126(212)171-94(54-71(3)4)128(214)166-90(35-28-51-159-145(154)155)124(210)164-87(32-22-25-48-147)122(208)167-92(45-46-107(151)196)127(213)168-93(47-53-232-16)121(207)163-77(13)118(204)185-113(74(9)10)139(225)169-89(34-24-27-50-149)123(209)165-88(33-23-26-49-148)125(211)173-97(58-81-37-41-84(194)42-38-81)131(217)172-95(55-72(5)6)129(215)175-100(61-108(152)197)132(218)183-106(69-191)138(224)186-115(76(12)18-2)141(227)177-96(56-73(7)8)130(216)180-103(144(230)231)62-109(153)198/h19-21,30-31,37-44,65,70-79,86-106,113-117,189-195H,17-18,22-29,32-36,45-64,66-69,147-150H2,1-16H3,(H2,151,196)(H2,152,197)(H2,153,198)(H,158,162)(H,161,206)(H,163,207)(H,164,210)(H,165,209)(H,166,214)(H,167,208)(H,168,213)(H,169,225)(H,170,228)(H,171,212)(H,172,217)(H,173,211)(H,174,223)(H,175,215)(H,176,222)(H,177,227)(H,178,226)(H,179,229)(H,180,216)(H,181,205)(H,182,219)(H,183,218)(H,184,199)(H,185,204)(H,186,224)(H,187,220)(H,188,221)(H,200,201)(H,202,203)(H,230,231)(H4,154,155,159)(H4,156,157,160) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 8 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 195: 535-41 (1991) Article DOI: 10.1111/j.1432-1033.1991.tb15734.x BindingDB Entry DOI: 10.7270/Q2RV0M66 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (RAT) | BDBM81536 (PACAP(5-38)) Show SMILES [#6]-[#6]-[#6](-[#6])-[#6@H](-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#16]-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](-[#7])=O |r| Show InChI InChI=1S/C188H311N57O46S/c1-18-103(12)147(199)180(287)237-137(88-108-40-20-19-21-41-108)177(284)245-151(107(16)248)184(291)239-139(94-146(257)258)176(283)241-141(97-247)179(286)235-136(92-112-59-67-116(252)68-60-112)174(281)240-140(96-246)178(285)225-126(51-38-83-211-187(205)206)166(273)233-134(90-110-55-63-114(250)64-56-110)172(279)224-124(49-36-81-209-185(201)202)162(269)219-119(44-24-31-76-191)159(266)227-129(70-72-143(197)254)168(275)228-130(73-85-292-17)157(264)215-106(15)155(262)242-148(100(6)7)181(288)229-122(47-27-34-79-194)161(268)220-121(46-26-33-78-193)163(270)234-135(91-111-57-65-115(251)66-58-111)173(280)231-132(87-99(4)5)170(277)216-104(13)153(260)214-105(14)154(261)243-149(101(8)9)183(290)238-131(86-98(2)3)156(263)213-95-145(256)217-118(43-23-30-75-190)158(265)221-125(50-37-82-210-186(203)204)165(272)232-133(89-109-53-61-113(249)62-54-109)171(278)223-120(45-25-32-77-192)160(267)226-128(69-71-142(196)253)167(274)222-127(52-39-84-212-188(207)208)169(276)244-150(102(10)11)182(289)230-123(48-28-35-80-195)164(271)236-138(93-144(198)255)175(282)218-117(152(200)259)42-22-29-74-189/h19-21,40-41,53-68,98-107,117-141,147-151,246-252H,18,22-39,42-52,69-97,189-195,199H2,1-17H3,(H2,196,253)(H2,197,254)(H2,198,255)(H2,200,259)(H,213,263)(H,214,260)(H,215,264)(H,216,277)(H,217,256)(H,218,282)(H,219,269)(H,220,268)(H,221,265)(H,222,274)(H,223,278)(H,224,279)(H,225,285)(H,226,267)(H,227,266)(H,228,275)(H,229,288)(H,230,289)(H,231,280)(H,232,272)(H,233,273)(H,234,270)(H,235,286)(H,236,271)(H,237,287)(H,238,290)(H,239,291)(H,240,281)(H,241,283)(H,242,262)(H,243,261)(H,244,276)(H,245,284)(H,257,258)(H4,201,202,209)(H4,203,204,210)(H4,205,206,211)(H4,207,208,212)/t103?,104-,105-,106-,107+,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,147-,148-,149-,150-,151-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 9 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Neuropharmacology 33: 1189-95 (1994) Article DOI: 10.1016/s0028-3908(05)80009-7 BindingDB Entry DOI: 10.7270/Q2251GP3 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (RAT) | BDBM82452 ([Arg2]PACAP(1-38)) Show SMILES CCC(C)[C@H](NC(=O)CNC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCCNC(N)=N)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](CCCCNC(N)=N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(N)=O |r| Show InChI InChI=1S/C205H345N69O52S/c1-18-110(12)162(270-156(286)101-238-170(297)148(97-157(287)288)265-177(304)127(48-26-35-82-231-200(218)219)245-168(295)124(213)95-119-99-230-104-239-119)198(325)258-133(49-27-36-83-232-201(220)221)185(312)274-163(114(16)277)199(326)267-149(98-158(289)290)192(319)269-151(103-276)194(321)263-146(94-118-60-68-123(281)69-61-118)190(317)268-150(102-275)193(320)252-136(52-39-86-235-204(226)227)181(308)261-144(92-116-56-64-121(279)65-57-116)188(315)251-134(50-37-84-233-202(222)223)176(303)246-128(43-21-30-77-208)173(300)254-139(71-73-153(215)283)183(310)255-140(74-88-327-17)171(298)241-113(15)167(294)271-159(107(6)7)195(322)256-131(46-24-33-80-211)175(302)247-130(45-23-32-79-210)178(305)262-145(93-117-58-66-122(280)67-59-117)189(316)259-142(90-106(4)5)186(313)242-111(13)165(292)240-112(14)166(293)272-160(108(8)9)197(324)266-141(89-105(2)3)169(296)237-100-155(285)243-126(42-20-29-76-207)172(299)248-135(51-38-85-234-203(224)225)180(307)260-143(91-115-54-62-120(278)63-55-115)187(314)250-129(44-22-31-78-209)174(301)253-138(70-72-152(214)282)182(309)249-137(53-40-87-236-205(228)229)184(311)273-161(109(10)11)196(323)257-132(47-25-34-81-212)179(306)264-147(96-154(216)284)191(318)244-125(164(217)291)41-19-28-75-206/h54-69,99,104-114,124-151,159-163,275-281H,18-53,70-98,100-103,206-213H2,1-17H3,(H2,214,282)(H2,215,283)(H2,216,284)(H2,217,291)(H,230,239)(H,237,296)(H,238,297)(H,240,292)(H,241,298)(H,242,313)(H,243,285)(H,244,318)(H,245,295)(H,246,303)(H,247,302)(H,248,299)(H,249,309)(H,250,314)(H,251,315)(H,252,320)(H,253,301)(H,254,300)(H,255,310)(H,256,322)(H,257,323)(H,258,325)(H,259,316)(H,260,307)(H,261,308)(H,262,305)(H,263,321)(H,264,306)(H,265,304)(H,266,324)(H,267,326)(H,268,317)(H,269,319)(H,270,286)(H,271,294)(H,272,293)(H,273,311)(H,274,312)(H,287,288)(H,289,290)(H4,218,219,231)(H4,220,221,232)(H4,222,223,233)(H4,224,225,234)(H4,226,227,235)(H4,228,229,236)/t110?,111-,112-,113-,114+,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,142-,143-,144-,145-,146-,147-,148-,149-,150-,151-,159-,160-,161-,162-,163-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Neuropharmacology 33: 1189-95 (1994) Article DOI: 10.1016/s0028-3908(05)80009-7 BindingDB Entry DOI: 10.7270/Q2251GP3 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (RAT) | BDBM81528 (PACAP(7-38)) Show SMILES [#6]-[#16]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](-[#7])=O |r| Show InChI InChI=1S/C173H291N55O44S/c1-89(2)78-120(143(246)198-86-133(239)202-107(35-17-24-67-175)145(248)206-114(42-31-74-195-171(188)189)152(255)217-122(80-98-45-53-102(232)54-46-98)158(261)208-109(37-19-26-69-177)147(250)211-117(61-63-130(181)236)154(257)207-116(44-33-76-197-173(192)193)156(259)228-138(93(9)10)168(271)215-112(40-22-29-72-180)151(254)221-126(84-132(183)238)162(265)203-106(139(185)242)34-16-23-66-174)223-169(272)137(92(7)8)227-141(244)95(12)199-140(243)94(11)201-157(260)121(79-90(3)4)216-160(263)124(82-100-49-57-104(234)58-50-100)219-150(253)110(38-20-27-70-178)205-148(251)111(39-21-28-71-179)214-167(270)136(91(5)6)226-142(245)96(13)200-144(247)119(65-77-273-15)213-155(258)118(62-64-131(182)237)212-146(249)108(36-18-25-68-176)204-149(252)113(41-30-73-194-170(186)187)209-159(262)123(81-99-47-55-103(233)56-48-99)218-153(256)115(43-32-75-196-172(190)191)210-164(267)128(87-229)224-161(264)125(83-101-51-59-105(235)60-52-101)220-165(268)129(88-230)225-163(266)127(85-134(240)241)222-166(269)135(184)97(14)231/h45-60,89-97,106-129,135-138,229-235H,16-44,61-88,174-180,184H2,1-15H3,(H2,181,236)(H2,182,237)(H2,183,238)(H2,185,242)(H,198,246)(H,199,243)(H,200,247)(H,201,260)(H,202,239)(H,203,265)(H,204,252)(H,205,251)(H,206,248)(H,207,257)(H,208,261)(H,209,262)(H,210,267)(H,211,250)(H,212,249)(H,213,258)(H,214,270)(H,215,271)(H,216,263)(H,217,255)(H,218,256)(H,219,253)(H,220,268)(H,221,254)(H,222,269)(H,223,272)(H,224,264)(H,225,266)(H,226,245)(H,227,244)(H,228,259)(H,240,241)(H4,186,187,194)(H4,188,189,195)(H4,190,191,196)(H4,192,193,197)/t94-,95-,96-,97+,106-,107-,108-,109-,110-,111-,112-,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,135-,136-,137-,138-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Neuropharmacology 33: 1189-95 (1994) Article DOI: 10.1016/s0028-3908(05)80009-7 BindingDB Entry DOI: 10.7270/Q2251GP3 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (RAT) | BDBM81763 (PACAP(3-38)) Show SMILES [#6]-[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#16]-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](-[#7])=O |r| Show InChI InChI=1S/C194H319N59O50S/c1-18-105(12)155(249-149(265)97-219-161(274)119(202)93-150(266)267)189(302)245-140(88-110-40-20-19-21-41-110)183(296)253-156(109(16)256)190(303)246-142(95-151(268)269)182(295)248-144(99-255)185(298)242-139(92-114-59-67-118(260)68-60-114)180(293)247-143(98-254)184(297)232-129(51-38-83-217-193(211)212)172(285)240-137(90-112-55-63-116(258)64-56-112)178(291)231-127(49-36-81-215-191(207)208)168(281)226-122(44-24-31-76-197)165(278)234-132(70-72-146(204)262)174(287)235-133(73-85-304-17)163(276)222-108(15)160(273)250-152(102(6)7)186(299)236-125(47-27-34-79-200)167(280)227-124(46-26-33-78-199)169(282)241-138(91-113-57-65-117(259)66-58-113)179(292)238-135(87-101(4)5)176(289)223-106(13)158(271)221-107(14)159(272)251-153(103(8)9)188(301)244-134(86-100(2)3)162(275)220-96-148(264)224-121(43-23-30-75-196)164(277)228-128(50-37-82-216-192(209)210)171(284)239-136(89-111-53-61-115(257)62-54-111)177(290)230-123(45-25-32-77-198)166(279)233-131(69-71-145(203)261)173(286)229-130(52-39-84-218-194(213)214)175(288)252-154(104(10)11)187(300)237-126(48-28-35-80-201)170(283)243-141(94-147(205)263)181(294)225-120(157(206)270)42-22-29-74-195/h19-21,40-41,53-68,100-109,119-144,152-156,254-260H,18,22-39,42-52,69-99,195-202H2,1-17H3,(H2,203,261)(H2,204,262)(H2,205,263)(H2,206,270)(H,219,274)(H,220,275)(H,221,271)(H,222,276)(H,223,289)(H,224,264)(H,225,294)(H,226,281)(H,227,280)(H,228,277)(H,229,286)(H,230,290)(H,231,291)(H,232,297)(H,233,279)(H,234,278)(H,235,287)(H,236,299)(H,237,300)(H,238,292)(H,239,284)(H,240,285)(H,241,282)(H,242,298)(H,243,283)(H,244,301)(H,245,302)(H,246,303)(H,247,293)(H,248,295)(H,249,265)(H,250,273)(H,251,272)(H,252,288)(H,253,296)(H,266,267)(H,268,269)(H4,207,208,215)(H4,209,210,216)(H4,211,212,217)(H4,213,214,218)/t105?,106-,107-,108-,109+,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,142-,143-,144-,152-,153-,154-,155-,156-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Neuropharmacology 33: 1189-95 (1994) Article DOI: 10.1016/s0028-3908(05)80009-7 BindingDB Entry DOI: 10.7270/Q2251GP3 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (Homo sapiens (Human)) | BDBM81524 ([Phe2]PACAP(1-38)) Show SMILES CCC(C)[C@H](NC(=O)CNC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(N)=O |r| Show InChI InChI=1S/C209H335N63O52S/c1-18-114(12)168(268-162(284)105-236-176(295)154(101-163(285)286)262-193(312)147(93-119-43-21-19-22-44-119)255-174(293)130(217)99-125-103-230-108-237-125)204(323)264-152(94-120-45-23-20-24-46-120)198(317)272-169(118(16)275)205(324)265-155(102-164(287)288)197(316)267-157(107-274)200(319)260-151(98-124-64-72-129(279)73-65-124)195(314)266-156(106-273)199(318)249-140(56-41-88-233-208(226)227)186(305)258-149(96-122-60-68-127(277)69-61-122)192(311)248-138(54-39-86-231-206(222)223)182(301)243-133(49-27-34-81-212)179(298)251-143(75-77-159(219)281)188(307)252-144(78-90-325-17)177(296)239-117(15)173(292)269-165(111(6)7)201(320)253-136(52-30-37-84-215)181(300)244-135(51-29-36-83-214)183(302)259-150(97-123-62-70-128(278)71-63-123)194(313)256-146(92-110(4)5)190(309)240-115(13)171(290)238-116(14)172(291)270-166(112(8)9)203(322)263-145(91-109(2)3)175(294)235-104-161(283)241-132(48-26-33-80-211)178(297)245-139(55-40-87-232-207(224)225)185(304)257-148(95-121-58-66-126(276)67-59-121)191(310)247-134(50-28-35-82-213)180(299)250-142(74-76-158(218)280)187(306)246-141(57-42-89-234-209(228)229)189(308)271-167(113(10)11)202(321)254-137(53-31-38-85-216)184(303)261-153(100-160(220)282)196(315)242-131(170(221)289)47-25-32-79-210/h19-24,43-46,58-73,103,108-118,130-157,165-169,273-279H,18,25-42,47-57,74-102,104-107,210-217H2,1-17H3,(H2,218,280)(H2,219,281)(H2,220,282)(H2,221,289)(H,230,237)(H,235,294)(H,236,295)(H,238,290)(H,239,296)(H,240,309)(H,241,283)(H,242,315)(H,243,301)(H,244,300)(H,245,297)(H,246,306)(H,247,310)(H,248,311)(H,249,318)(H,250,299)(H,251,298)(H,252,307)(H,253,320)(H,254,321)(H,255,293)(H,256,313)(H,257,304)(H,258,305)(H,259,302)(H,260,319)(H,261,303)(H,262,312)(H,263,322)(H,264,323)(H,265,324)(H,266,314)(H,267,316)(H,268,284)(H,269,292)(H,270,291)(H,271,308)(H,272,317)(H,285,286)(H,287,288)(H4,222,223,231)(H4,224,225,232)(H4,226,227,233)(H4,228,229,234)/t114?,115-,116-,117-,118+,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,142-,143-,144-,145-,146-,147-,148-,149-,150-,151-,152-,153-,154-,155-,156-,157-,165-,166-,167-,168-,169-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 207: 239-46 (1992) Article DOI: 10.1111/j.1432-1033.1992.tb17043.x BindingDB Entry DOI: 10.7270/Q2WM1BW2 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (Homo sapiens (Human)) | BDBM81531 ([D-Phe2]PACAP-38 | [DPhe2]PACAP(1-38)) Show SMILES CCC(C)[C@H](NC(=O)CNC(=O)[C@H](CC(O)=O)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(N)=O |r| Show InChI InChI=1S/C209H335N63O52S/c1-18-114(12)168(268-162(284)105-236-176(295)154(101-163(285)286)262-193(312)147(93-119-43-21-19-22-44-119)255-174(293)130(217)99-125-103-230-108-237-125)204(323)264-152(94-120-45-23-20-24-46-120)198(317)272-169(118(16)275)205(324)265-155(102-164(287)288)197(316)267-157(107-274)200(319)260-151(98-124-64-72-129(279)73-65-124)195(314)266-156(106-273)199(318)249-140(56-41-88-233-208(226)227)186(305)258-149(96-122-60-68-127(277)69-61-122)192(311)248-138(54-39-86-231-206(222)223)182(301)243-133(49-27-34-81-212)179(298)251-143(75-77-159(219)281)188(307)252-144(78-90-325-17)177(296)239-117(15)173(292)269-165(111(6)7)201(320)253-136(52-30-37-84-215)181(300)244-135(51-29-36-83-214)183(302)259-150(97-123-62-70-128(278)71-63-123)194(313)256-146(92-110(4)5)190(309)240-115(13)171(290)238-116(14)172(291)270-166(112(8)9)203(322)263-145(91-109(2)3)175(294)235-104-161(283)241-132(48-26-33-80-211)178(297)245-139(55-40-87-232-207(224)225)185(304)257-148(95-121-58-66-126(276)67-59-121)191(310)247-134(50-28-35-82-213)180(299)250-142(74-76-158(218)280)187(306)246-141(57-42-89-234-209(228)229)189(308)271-167(113(10)11)202(321)254-137(53-31-38-85-216)184(303)261-153(100-160(220)282)196(315)242-131(170(221)289)47-25-32-79-210/h19-24,43-46,58-73,103,108-118,130-157,165-169,273-279H,18,25-42,47-57,74-102,104-107,210-217H2,1-17H3,(H2,218,280)(H2,219,281)(H2,220,282)(H2,221,289)(H,230,237)(H,235,294)(H,236,295)(H,238,290)(H,239,296)(H,240,309)(H,241,283)(H,242,315)(H,243,301)(H,244,300)(H,245,297)(H,246,306)(H,247,310)(H,248,311)(H,249,318)(H,250,299)(H,251,298)(H,252,307)(H,253,320)(H,254,321)(H,255,293)(H,256,313)(H,257,304)(H,258,305)(H,259,302)(H,260,319)(H,261,303)(H,262,312)(H,263,322)(H,264,323)(H,265,324)(H,266,314)(H,267,316)(H,268,284)(H,269,292)(H,270,291)(H,271,308)(H,272,317)(H,285,286)(H,287,288)(H4,222,223,231)(H4,224,225,232)(H4,226,227,233)(H4,228,229,234)/t114?,115-,116-,117-,118+,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,142-,143-,144-,145-,146-,147+,148-,149-,150-,151-,152-,153-,154-,155-,156-,157-,165-,166-,167-,168-,169-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 207: 239-46 (1992) Article DOI: 10.1111/j.1432-1033.1992.tb17043.x BindingDB Entry DOI: 10.7270/Q2WM1BW2 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (Homo sapiens (Human)) | BDBM81525 ([AcHis1,Phe2]PACAP(1-38)) Show SMILES CCC(C)[C@H](NC(=O)CNC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(C)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(N)=O |r| Show InChI InChI=1S/C211H337N63O53S/c1-19-115(12)170(270-164(287)106-237-177(297)156(102-165(288)289)264-195(315)148(94-121-44-22-20-23-45-121)261-197(317)154(242-120(17)278)100-127-104-231-109-238-127)206(326)266-153(95-122-46-24-21-25-47-122)200(320)274-171(119(16)277)207(327)267-157(103-166(290)291)199(319)269-159(108-276)202(322)262-152(99-126-65-73-131(282)74-66-126)196(316)268-158(107-275)201(321)251-141(57-42-89-234-210(227)228)187(307)259-150(97-124-61-69-129(280)70-62-124)193(313)250-139(55-40-87-232-208(223)224)183(303)245-134(50-28-35-82-214)180(300)253-144(76-78-161(220)284)189(309)254-145(79-91-328-18)178(298)240-118(15)175(295)271-167(112(6)7)203(323)255-137(53-31-38-85-217)182(302)246-136(52-30-37-84-216)184(304)260-151(98-125-63-71-130(281)72-64-125)194(314)257-147(93-111(4)5)191(311)241-116(13)173(293)239-117(14)174(294)272-168(113(8)9)205(325)265-146(92-110(2)3)176(296)236-105-163(286)243-133(49-27-34-81-213)179(299)247-140(56-41-88-233-209(225)226)186(306)258-149(96-123-59-67-128(279)68-60-123)192(312)249-135(51-29-36-83-215)181(301)252-143(75-77-160(219)283)188(308)248-142(58-43-90-235-211(229)230)190(310)273-169(114(10)11)204(324)256-138(54-32-39-86-218)185(305)263-155(101-162(221)285)198(318)244-132(172(222)292)48-26-33-80-212/h20-25,44-47,59-74,104,109-119,132-159,167-171,275-277,279-282H,19,26-43,48-58,75-103,105-108,212-218H2,1-18H3,(H2,219,283)(H2,220,284)(H2,221,285)(H2,222,292)(H,231,238)(H,236,296)(H,237,297)(H,239,293)(H,240,298)(H,241,311)(H,242,278)(H,243,286)(H,244,318)(H,245,303)(H,246,302)(H,247,299)(H,248,308)(H,249,312)(H,250,313)(H,251,321)(H,252,301)(H,253,300)(H,254,309)(H,255,323)(H,256,324)(H,257,314)(H,258,306)(H,259,307)(H,260,304)(H,261,317)(H,262,322)(H,263,305)(H,264,315)(H,265,325)(H,266,326)(H,267,327)(H,268,316)(H,269,319)(H,270,287)(H,271,295)(H,272,294)(H,273,310)(H,274,320)(H,288,289)(H,290,291)(H4,223,224,232)(H4,225,226,233)(H4,227,228,234)(H4,229,230,235)/t115?,116-,117-,118-,119+,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,142-,143-,144-,145-,146-,147-,148-,149-,150-,151-,152-,153-,154-,155-,156-,157-,158-,159-,167-,168-,169-,170-,171-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 207: 239-46 (1992) Article DOI: 10.1111/j.1432-1033.1992.tb17043.x BindingDB Entry DOI: 10.7270/Q2WM1BW2 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (Homo sapiens (Human)) | BDBM81539 ([AcHis1,DPhe2]PACAP(1-38)) Show SMILES CCC(C)[C@H](NC(=O)CNC[C@H](CC(O)=O)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(C)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(N)=O |r| Show InChI InChI=1S/C211H339N63O52S/c1-19-116(12)171(270-164(286)106-231-105-129(101-166(288)289)243-192(311)150(94-122-44-22-20-23-45-122)262-197(316)156(242-121(17)278)100-128-104-232-110-238-128)206(325)266-155(95-123-46-24-21-25-47-123)200(319)274-172(120(16)277)207(326)267-158(103-167(290)291)199(318)269-160(109-276)202(321)263-154(99-127-65-73-133(282)74-66-127)196(315)268-159(108-275)201(320)252-143(57-42-89-235-210(227)228)187(306)260-152(97-125-61-69-131(280)70-62-125)194(313)251-141(55-40-87-233-208(223)224)183(302)246-136(50-28-35-82-214)180(299)254-146(76-78-162(220)284)189(308)255-147(79-91-327-18)178(297)240-119(15)176(295)271-168(113(6)7)203(322)256-139(53-31-38-85-217)182(301)247-138(52-30-37-84-216)184(303)261-153(98-126-63-71-132(281)72-64-126)195(314)258-149(93-112(4)5)191(310)241-117(13)174(293)239-118(14)175(294)272-169(114(8)9)205(324)265-148(92-111(2)3)177(296)237-107-165(287)244-135(49-27-34-81-213)179(298)248-142(56-41-88-234-209(225)226)186(305)259-151(96-124-59-67-130(279)68-60-124)193(312)250-137(51-29-36-83-215)181(300)253-145(75-77-161(219)283)188(307)249-144(58-43-90-236-211(229)230)190(309)273-170(115(10)11)204(323)257-140(54-32-39-86-218)185(304)264-157(102-163(221)285)198(317)245-134(173(222)292)48-26-33-80-212/h20-25,44-47,59-74,104,110-120,129,134-160,168-172,231,275-277,279-282H,19,26-43,48-58,75-103,105-109,212-218H2,1-18H3,(H2,219,283)(H2,220,284)(H2,221,285)(H2,222,292)(H,232,238)(H,237,296)(H,239,293)(H,240,297)(H,241,310)(H,242,278)(H,243,311)(H,244,287)(H,245,317)(H,246,302)(H,247,301)(H,248,298)(H,249,307)(H,250,312)(H,251,313)(H,252,320)(H,253,300)(H,254,299)(H,255,308)(H,256,322)(H,257,323)(H,258,314)(H,259,305)(H,260,306)(H,261,303)(H,262,316)(H,263,321)(H,264,304)(H,265,324)(H,266,325)(H,267,326)(H,268,315)(H,269,318)(H,270,286)(H,271,295)(H,272,294)(H,273,309)(H,274,319)(H,288,289)(H,290,291)(H4,223,224,233)(H4,225,226,234)(H4,227,228,235)(H4,229,230,236)/t116?,117-,118-,119-,120+,129-,134-,135-,136-,137-,138-,139-,140-,141-,142-,143-,144-,145-,146-,147-,148-,149-,150+,151-,152-,153-,154-,155-,156-,157-,158-,159-,160-,168-,169-,170-,171-,172-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 207: 239-46 (1992) Article DOI: 10.1111/j.1432-1033.1992.tb17043.x BindingDB Entry DOI: 10.7270/Q2WM1BW2 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Pituitary adenylate cyclase-activating polypeptide (RAT) | BDBM82446 ([DArg2]PACAP(1-38)) Show SMILES CCC(C)[C@H](NC(=O)CNC(=O)[C@H](CC(O)=O)NC(=O)[C@@H](CCCCNC(N)=N)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](CCCCNC(N)=N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(N)=O |r| Show InChI InChI=1S/C205H345N69O52S/c1-18-110(12)162(270-156(286)101-238-170(297)148(97-157(287)288)265-177(304)127(48-26-35-82-231-200(218)219)245-168(295)124(213)95-119-99-230-104-239-119)198(325)258-133(49-27-36-83-232-201(220)221)185(312)274-163(114(16)277)199(326)267-149(98-158(289)290)192(319)269-151(103-276)194(321)263-146(94-118-60-68-123(281)69-61-118)190(317)268-150(102-275)193(320)252-136(52-39-86-235-204(226)227)181(308)261-144(92-116-56-64-121(279)65-57-116)188(315)251-134(50-37-84-233-202(222)223)176(303)246-128(43-21-30-77-208)173(300)254-139(71-73-153(215)283)183(310)255-140(74-88-327-17)171(298)241-113(15)167(294)271-159(107(6)7)195(322)256-131(46-24-33-80-211)175(302)247-130(45-23-32-79-210)178(305)262-145(93-117-58-66-122(280)67-59-117)189(316)259-142(90-106(4)5)186(313)242-111(13)165(292)240-112(14)166(293)272-160(108(8)9)197(324)266-141(89-105(2)3)169(296)237-100-155(285)243-126(42-20-29-76-207)172(299)248-135(51-38-85-234-203(224)225)180(307)260-143(91-115-54-62-120(278)63-55-115)187(314)250-129(44-22-31-78-209)174(301)253-138(70-72-152(214)282)182(309)249-137(53-40-87-236-205(228)229)184(311)273-161(109(10)11)196(323)257-132(47-25-34-81-212)179(306)264-147(96-154(216)284)191(318)244-125(164(217)291)41-19-28-75-206/h54-69,99,104-114,124-151,159-163,275-281H,18-53,70-98,100-103,206-213H2,1-17H3,(H2,214,282)(H2,215,283)(H2,216,284)(H2,217,291)(H,230,239)(H,237,296)(H,238,297)(H,240,292)(H,241,298)(H,242,313)(H,243,285)(H,244,318)(H,245,295)(H,246,303)(H,247,302)(H,248,299)(H,249,309)(H,250,314)(H,251,315)(H,252,320)(H,253,301)(H,254,300)(H,255,310)(H,256,322)(H,257,323)(H,258,325)(H,259,316)(H,260,307)(H,261,308)(H,262,305)(H,263,321)(H,264,306)(H,265,304)(H,266,324)(H,267,326)(H,268,317)(H,269,319)(H,270,286)(H,271,294)(H,272,293)(H,273,311)(H,274,312)(H,287,288)(H,289,290)(H4,218,219,231)(H4,220,221,232)(H4,222,223,233)(H4,224,225,234)(H4,226,227,235)(H4,228,229,236)/t110?,111-,112-,113-,114+,124-,125-,126-,127+,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,142-,143-,144-,145-,146-,147-,148-,149-,150-,151-,159-,160-,161-,162-,163-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Neuropharmacology 33: 1189-95 (1994) Article DOI: 10.1016/s0028-3908(05)80009-7 BindingDB Entry DOI: 10.7270/Q2251GP3 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| VIP peptides (RAT) | BDBM82362 (VIP-PACAP) Show SMILES CSCCC(NC(=O)C(CCC(N)=O)NC(=O)C(CCCCN)NC(=O)C(CCCN=C(N)N)NC(=O)C(CC(C)C)NC(=O)C(CCCN=C(N)N)NC(=O)C(NC(=O)C(Cc1ccc(O)cc1)NC(=O)C(CC(N)=O)NC(=O)C(CC(O)=O)NC(=O)C(NC(=O)C(Cc1ccccc1)NC(=O)C(NC(=O)C(C)NC(=O)C(CC(O)=O)NC(=O)C(CO)NC(=O)C(N)Cc1cnc[nH]1)C(C)C)C(C)O)C(C)O)C(=O)NC(C)C(=O)NC(C(C)C)C(=O)NC(CCCCN)C(=O)NC(CCCCN)C(=O)NC(Cc1ccc(O)cc1)C(=O)NC(CC(C)C)C(=O)NC(C)C(=O)NC(C)C(=O)NC(C(C)C)C(=O)NC(CC(C)C)C(N)=O |(16.93,9.92,;18.27,9.15,;18.27,7.61,;16.93,6.84,;16.93,5.3,;15.6,4.53,;14.06,5.3,;14.06,6.84,;12.73,4.53,;12.73,2.99,;14.06,2.22,;14.06,.68,;12.73,-.09,;15.39,-.09,;11.39,5.3,;9.85,4.53,;9.85,2.99,;8.52,5.3,;8.52,6.84,;7.19,7.61,;7.19,9.15,;5.85,9.92,;4.52,9.15,;7.19,4.53,;7.91,-6.25,;7.91,-7.79,;9.24,-5.48,;9.24,-3.94,;7.91,-3.17,;7.91,-1.63,;6.57,-.86,;5.24,-1.63,;3.91,-.86,;5.24,-3.17,;10.58,-6.25,;12.12,-5.48,;12.12,-3.94,;13.45,-6.25,;13.45,-7.79,;12.12,-8.56,;12.12,-10.1,;10.78,-7.79,;14.78,-5.48,;16.32,-6.25,;16.32,-7.79,;17.66,-5.48,;17.66,-3.94,;16.32,-3.17,;16.32,-1.63,;17.66,-.86,;17.66,.68,;18.99,1.45,;16.32,1.45,;18.99,-6.25,;20.53,-5.48,;20.53,-3.94,;21.86,-6.25,;23.2,-5.48,;24.74,-6.25,;24.74,-7.79,;26.07,-5.48,;26.07,-3.94,;24.74,-3.17,;24.74,-1.63,;23.4,-.86,;22.07,-1.63,;20.74,-.86,;22.07,-3.17,;23.4,-3.94,;27.41,-6.25,;28.95,-5.48,;28.95,-3.94,;30.28,-6.25,;30.28,-7.79,;28.95,-8.56,;28.95,-10.1,;27.61,-7.79,;31.61,-5.48,;33.15,-6.25,;33.15,-7.79,;34.49,-5.48,;34.49,-3.94,;35.82,-3.17,;35.82,-1.63,;37.15,-3.94,;35.82,-6.25,;35.1,-17.03,;35.1,-18.57,;33.76,-16.26,;32.43,-17.03,;30.89,-16.26,;30.89,-14.72,;29.56,-17.03,;29.56,-18.57,;30.89,-19.34,;30.89,-20.88,;32.22,-21.65,;33.56,-20.88,;33.56,-19.34,;32.22,-18.57,;28.22,-16.26,;26.68,-17.03,;26.68,-18.57,;25.35,-16.26,;24.02,-17.03,;22.48,-16.26,;22.48,-14.72,;21.14,-17.03,;21.14,-18.57,;19.81,-16.26,;18.27,-17.03,;18.27,-18.57,;16.93,-16.26,;16.93,-14.72,;18.27,-13.95,;18.27,-12.41,;19.6,-14.72,;15.6,-17.03,;14.06,-16.26,;14.06,-14.72,;12.73,-17.03,;12.73,-18.57,;14.06,-19.34,;11.39,-16.26,;9.85,-17.03,;9.85,-18.57,;8.52,-16.26,;7.19,-17.03,;8.52,-14.72,;7.19,-13.95,;7.03,-12.42,;5.52,-12.1,;4.75,-13.43,;5.78,-14.58,;25.35,-14.72,;26.68,-13.95,;24.02,-13.95,;33.76,-14.72,;32.43,-13.95,;35.1,-13.95,;21.86,-7.79,;23.2,-8.56,;20.53,-8.56,;18.27,4.53,;18.27,2.99,;19.81,5.3,;21.14,4.53,;21.14,2.99,;22.48,5.3,;22.48,6.84,;24.02,4.53,;25.35,5.3,;25.35,6.84,;26.68,7.61,;24.02,7.61,;26.68,4.53,;26.68,2.99,;28.22,5.3,;29.56,4.53,;29.56,2.99,;30.89,2.22,;30.89,.68,;32.22,-.09,;33.56,.68,;30.89,5.3,;30.89,6.84,;32.43,4.53,;33.76,5.3,;33.76,6.84,;35.1,7.61,;36.43,6.84,;37.77,7.61,;39.1,6.84,;35.1,4.53,;35.1,2.99,;35.82,15.31,;34.49,16.08,;34.49,17.62,;35.82,18.39,;37.15,17.62,;38.49,18.39,;38.49,19.93,;39.82,20.7,;37.15,20.7,;35.82,19.93,;33.15,15.31,;33.15,13.77,;31.61,16.08,;30.28,15.31,;30.28,13.77,;28.95,13,;28.95,11.46,;27.61,13.77,;28.95,16.08,;28.95,17.62,;27.41,15.31,;26.07,16.08,;26.07,17.62,;24.74,15.31,;24.74,13.77,;23.2,16.08,;21.86,15.31,;21.86,13.77,;20.53,16.08,;20.53,17.62,;18.99,15.31,;17.66,16.08,;17.66,17.62,;16.32,18.39,;18.99,18.39,;16.32,15.31,;16.32,13.77,;14.78,16.08,;13.45,15.31,;13.45,13.77,;12.12,13,;12.12,11.46,;10.78,13.77,;12.12,16.08,;10.58,15.31,;12.12,17.62,)| Show InChI InChI=1S/C141H229N41O38S/c1-68(2)55-94(113(148)194)168-136(217)109(72(9)10)179-115(196)75(14)157-114(195)74(13)159-126(207)95(56-69(3)4)170-129(210)97(59-81-38-42-84(186)43-39-81)171-123(204)88(34-24-27-50-143)162-121(202)89(35-25-28-51-144)166-135(216)108(71(7)8)178-116(197)76(15)158-119(200)93(48-54-221-19)165-125(206)92(46-47-104(146)188)164-120(201)87(33-23-26-49-142)161-122(203)90(36-29-52-154-140(149)150)163-128(209)96(57-70(5)6)169-124(205)91(37-30-53-155-141(151)152)167-138(219)111(78(17)184)181-132(213)98(60-82-40-44-85(187)45-41-82)172-130(211)100(62-105(147)189)173-131(212)102(64-107(192)193)176-139(220)112(79(18)185)182-133(214)99(58-80-31-21-20-22-32-80)175-137(218)110(73(11)12)180-117(198)77(16)160-127(208)101(63-106(190)191)174-134(215)103(66-183)177-118(199)86(145)61-83-65-153-67-156-83/h20-22,31-32,38-45,65,67-79,86-103,108-112,183-187H,23-30,33-37,46-64,66,142-145H2,1-19H3,(H2,146,188)(H2,147,189)(H2,148,194)(H,153,156)(H,157,195)(H,158,200)(H,159,207)(H,160,208)(H,161,203)(H,162,202)(H,163,209)(H,164,201)(H,165,206)(H,166,216)(H,167,219)(H,168,217)(H,169,205)(H,170,210)(H,171,204)(H,172,211)(H,173,212)(H,174,215)(H,175,218)(H,176,220)(H,177,199)(H,178,197)(H,179,196)(H,180,198)(H,181,213)(H,182,214)(H,190,191)(H,192,193)(H4,149,150,154)(H4,151,152,155) | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 195: 535-41 (1991) Article DOI: 10.1111/j.1432-1033.1991.tb15734.x BindingDB Entry DOI: 10.7270/Q2RV0M66 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| VIP peptides (RAT) | BDBM82356 (PACAP(2-38)) Show SMILES [#6]-[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#16]-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](-[#7])=O |r| Show InChI InChI=1S/C197H324N60O52S/c1-18-106(12)157(253-151(270)97-223-165(281)143(94-152(271)272)241-163(279)120(205)98-258)192(308)249-141(88-111-40-20-19-21-41-111)186(302)257-158(110(16)261)193(309)250-144(95-153(273)274)185(301)252-146(100-260)188(304)246-140(92-115-59-67-119(265)68-60-115)183(299)251-145(99-259)187(303)235-130(51-38-83-220-196(214)215)175(291)244-138(90-113-55-63-117(263)64-56-113)181(297)234-128(49-36-81-218-194(210)211)171(287)229-123(44-24-31-76-200)168(284)237-133(70-72-148(207)267)177(293)238-134(73-85-310-17)166(282)225-109(15)162(278)254-154(103(6)7)189(305)239-126(47-27-34-79-203)170(286)230-125(46-26-33-78-202)172(288)245-139(91-114-57-65-118(264)66-58-114)182(298)242-136(87-102(4)5)179(295)226-107(13)160(276)224-108(14)161(277)255-155(104(8)9)191(307)248-135(86-101(2)3)164(280)222-96-150(269)227-122(43-23-30-75-199)167(283)231-129(50-37-82-219-195(212)213)174(290)243-137(89-112-53-61-116(262)62-54-112)180(296)233-124(45-25-32-77-201)169(285)236-132(69-71-147(206)266)176(292)232-131(52-39-84-221-197(216)217)178(294)256-156(105(10)11)190(306)240-127(48-28-35-80-204)173(289)247-142(93-149(208)268)184(300)228-121(159(209)275)42-22-29-74-198/h19-21,40-41,53-68,101-110,120-146,154-158,258-265H,18,22-39,42-52,69-100,198-205H2,1-17H3,(H2,206,266)(H2,207,267)(H2,208,268)(H2,209,275)(H,222,280)(H,223,281)(H,224,276)(H,225,282)(H,226,295)(H,227,269)(H,228,300)(H,229,287)(H,230,286)(H,231,283)(H,232,292)(H,233,296)(H,234,297)(H,235,303)(H,236,285)(H,237,284)(H,238,293)(H,239,305)(H,240,306)(H,241,279)(H,242,298)(H,243,290)(H,244,291)(H,245,288)(H,246,304)(H,247,289)(H,248,307)(H,249,308)(H,250,309)(H,251,299)(H,252,301)(H,253,270)(H,254,278)(H,255,277)(H,256,294)(H,257,302)(H,271,272)(H,273,274)(H4,210,211,218)(H4,212,213,219)(H4,214,215,220)(H4,216,217,221)/t106?,107-,108-,109-,110+,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,142-,143-,144-,145-,146-,154-,155-,156-,157-,158-/m0/s1 | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 195: 535-41 (1991) Article DOI: 10.1111/j.1432-1033.1991.tb15734.x BindingDB Entry DOI: 10.7270/Q2RV0M66 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| VIP peptides (Homo sapiens (Human)) | BDBM82360 ([Ser9,Tyr13]VIP) Show SMILES CCC(C)C(NC(=O)C(CO)NC(=O)C(CC(N)=O)NC(=O)C(CC(C)C)NC(=O)C(Cc1ccc(O)cc1)NC(=O)C(CCCCN)NC(=O)C(CCCCN)NC(=O)C(NC(=O)C(C)NC(=O)C(CCSC)NC(=O)C(CCC(N)=O)NC(=O)C(CCCCN)NC(=O)C(CCCN=C(N)N)NC(=O)C(Cc1ccc(O)cc1)NC(=O)C(CCCN=C(N)N)NC(=O)C(NC(=O)C(Cc1ccc(O)cc1)NC(=O)C(CO)NC(=O)C(CC(O)=O)NC(=O)C(NC(=O)C(Cc1ccccc1)NC(=O)C(NC(=O)C(C)NC(=O)C(CC(O)=O)NC(=O)C(CO)NC(=O)C(N)Cc1cnc[nH]1)C(C)C)C(C)O)C(C)O)C(C)C)C(=O)NC(CC(C)C)C(=O)NC(CC(N)=O)C(O)=O |(16.32,19.93,;16.32,18.39,;17.66,17.62,;18.99,18.39,;17.66,16.08,;18.99,15.31,;20.53,16.08,;20.53,17.62,;21.86,15.31,;21.86,13.77,;20.53,13,;23.2,16.08,;24.74,15.31,;24.74,13.77,;26.07,16.08,;26.07,17.62,;24.74,18.39,;24.74,19.93,;23.4,17.62,;27.41,15.31,;28.95,16.08,;28.95,17.62,;30.28,15.31,;30.28,13.77,;28.95,13,;28.95,11.46,;27.61,13.77,;31.61,16.08,;33.15,15.31,;33.15,13.77,;34.49,16.08,;34.49,17.62,;35.82,18.39,;37.15,17.62,;38.49,18.39,;38.49,19.93,;39.82,20.7,;37.15,20.7,;35.82,19.93,;35.82,15.31,;35.1,4.53,;35.1,2.99,;33.76,5.3,;33.76,6.84,;35.1,7.61,;36.43,6.84,;37.77,7.61,;39.1,6.84,;32.43,4.53,;30.89,5.3,;30.89,6.84,;29.56,4.53,;29.56,2.99,;30.89,2.22,;30.89,.68,;32.22,-.09,;33.56,.68,;28.22,5.3,;26.68,4.53,;26.68,2.99,;25.35,5.3,;24.02,4.53,;22.48,5.3,;22.48,6.84,;21.14,4.53,;21.14,2.99,;19.81,5.3,;18.27,4.53,;18.27,2.99,;16.93,5.3,;16.93,6.84,;18.27,7.61,;18.27,9.15,;16.93,9.92,;15.6,4.53,;14.06,5.3,;14.06,6.84,;12.73,4.53,;12.73,2.99,;14.06,2.22,;14.06,.68,;12.73,-.09,;15.39,-.09,;11.39,5.3,;9.85,4.53,;9.85,2.99,;8.52,5.3,;8.52,6.84,;7.19,7.61,;7.19,9.15,;5.85,9.92,;4.52,9.15,;7.19,4.53,;7.91,-6.25,;7.91,-7.79,;9.24,-5.48,;9.24,-3.94,;7.91,-3.17,;7.91,-1.63,;6.57,-.86,;5.24,-1.63,;3.91,-.86,;5.24,-3.17,;10.58,-6.25,;12.12,-5.48,;12.12,-3.94,;13.45,-6.25,;13.45,-7.79,;12.22,-8.2,;10.89,-7.43,;9.56,-8.2,;9.56,-9.74,;8.07,-10.13,;10.89,-10.51,;12.22,-9.74,;14.78,-5.48,;16.32,-6.25,;16.32,-7.79,;17.66,-5.48,;17.66,-3.94,;16.32,-3.17,;16.32,-1.63,;17.66,-.86,;17.66,.68,;18.99,1.45,;16.32,1.45,;18.99,-6.25,;20.53,-5.48,;20.53,-3.94,;21.86,-6.25,;23.2,-5.48,;24.74,-6.25,;24.74,-7.79,;26.07,-5.48,;26.07,-3.94,;24.74,-3.17,;24.74,-1.63,;23.4,-.86,;22.07,-1.63,;20.74,-.86,;22.07,-3.17,;23.4,-3.94,;27.41,-6.25,;28.95,-5.48,;28.95,-3.94,;30.28,-6.25,;30.28,-7.79,;28.95,-8.56,;31.61,-5.48,;33.15,-6.25,;33.15,-7.79,;34.49,-5.48,;34.49,-3.94,;35.82,-3.17,;35.82,-1.63,;37.15,-3.94,;35.82,-6.25,;35.1,-17.03,;35.1,-18.57,;33.76,-16.26,;32.43,-17.03,;30.89,-16.26,;30.89,-14.72,;29.56,-17.03,;29.56,-18.57,;30.89,-19.34,;30.89,-20.88,;32.22,-21.65,;33.56,-20.88,;33.56,-19.34,;32.22,-18.57,;28.22,-16.26,;26.68,-17.03,;26.68,-18.57,;25.35,-16.26,;24.02,-17.03,;22.48,-16.26,;22.48,-14.72,;21.14,-17.03,;21.14,-18.57,;19.81,-16.26,;18.27,-17.03,;18.27,-18.57,;16.93,-16.26,;16.93,-14.72,;18.27,-13.95,;18.27,-12.41,;19.6,-14.72,;15.6,-17.03,;14.06,-16.26,;14.06,-14.72,;12.73,-17.03,;12.73,-18.57,;14.06,-19.34,;11.39,-16.26,;9.85,-17.03,;9.85,-18.57,;8.52,-16.26,;7.19,-17.03,;8.52,-14.72,;7.19,-13.95,;7.03,-12.42,;5.52,-12.1,;4.75,-13.43,;5.78,-14.58,;25.35,-14.72,;26.68,-13.95,;24.02,-13.95,;33.76,-14.72,;32.43,-13.95,;35.1,-13.95,;21.86,-7.79,;23.2,-8.56,;20.53,-8.56,;25.35,6.84,;26.68,7.61,;24.02,7.61,;16.32,15.31,;16.32,13.77,;14.78,16.08,;13.45,15.31,;13.45,13.77,;12.12,13,;12.12,11.46,;10.78,13.77,;12.12,16.08,;12.12,17.62,;10.58,15.31,;9.24,16.08,;9.24,17.62,;7.91,18.39,;7.91,19.93,;6.57,17.62,;7.91,15.31,;6.57,16.08,;7.91,13.77,)| Show InChI InChI=1S/C149H234N42O44S/c1-16-76(10)117(144(231)180-98(57-73(4)5)132(219)183-106(147(234)235)64-112(156)202)189-141(228)109(70-194)186-135(222)103(63-111(155)201)178-131(218)97(56-72(2)3)174-134(221)100(60-83-37-43-87(198)44-38-83)176-127(214)91(31-21-24-51-151)168-125(212)92(32-22-25-52-152)172-142(229)115(74(6)7)187-120(207)77(11)165-123(210)96(49-55-236-15)171-129(216)95(47-48-110(154)200)170-124(211)90(30-20-23-50-150)167-126(213)93(33-26-53-162-148(157)158)169-133(220)99(59-82-35-41-86(197)42-36-82)175-128(215)94(34-27-54-163-149(159)160)173-145(232)118(79(13)195)190-137(224)101(61-84-39-45-88(199)46-40-84)177-140(227)108(69-193)185-136(223)105(66-114(205)206)182-146(233)119(80(14)196)191-138(225)102(58-81-28-18-17-19-29-81)181-143(230)116(75(8)9)188-121(208)78(12)166-130(217)104(65-113(203)204)179-139(226)107(68-192)184-122(209)89(153)62-85-67-161-71-164-85/h17-19,28-29,35-46,67,71-80,89-109,115-119,192-199H,16,20-27,30-34,47-66,68-70,150-153H2,1-15H3,(H2,154,200)(H2,155,201)(H2,156,202)(H,161,164)(H,165,210)(H,166,217)(H,167,213)(H,168,212)(H,169,220)(H,170,211)(H,171,216)(H,172,229)(H,173,232)(H,174,221)(H,175,215)(H,176,214)(H,177,227)(H,178,218)(H,179,226)(H,180,231)(H,181,230)(H,182,233)(H,183,219)(H,184,209)(H,185,223)(H,186,222)(H,187,207)(H,188,208)(H,189,228)(H,190,224)(H,191,225)(H,203,204)(H,205,206)(H,234,235)(H4,157,158,162)(H4,159,160,163) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 15 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 195: 535-41 (1991) Article DOI: 10.1111/j.1432-1033.1991.tb15734.x BindingDB Entry DOI: 10.7270/Q2RV0M66 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| VIP peptides (Homo sapiens (Human)) | BDBM82361 (PACAP(2-27)) Show SMILES [#6]-[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#16]-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](-[#7])=O |r| Show InChI InChI=1S/C137H219N37O38S/c1-16-73(10)109(171-104(183)65-150-116(193)91(48-50-105(184)185)154-115(192)85(141)66-175)134(211)167-99(60-78-28-18-17-19-29-78)129(206)174-110(77(14)178)135(212)168-100(64-106(186)187)128(205)170-102(68-177)131(208)166-98(63-81-39-45-84(181)46-40-81)127(204)169-101(67-176)130(207)158-90(34-27-56-149-137(146)147)122(199)164-96(61-79-35-41-82(179)42-36-79)125(202)157-89(33-26-55-148-136(144)145)120(197)155-86(30-20-23-52-138)118(195)159-92(47-49-103(142)182)123(200)160-93(51-57-213-15)117(194)152-76(13)114(191)172-107(71(6)7)132(209)161-88(32-22-25-54-140)119(196)156-87(31-21-24-53-139)121(198)165-97(62-80-37-43-83(180)44-38-80)126(203)163-95(59-70(4)5)124(201)153-74(11)112(189)151-75(12)113(190)173-108(72(8)9)133(210)162-94(111(143)188)58-69(2)3/h17-19,28-29,35-46,69-77,85-102,107-110,175-181H,16,20-27,30-34,47-68,138-141H2,1-15H3,(H2,142,182)(H2,143,188)(H,150,193)(H,151,189)(H,152,194)(H,153,201)(H,154,192)(H,155,197)(H,156,196)(H,157,202)(H,158,207)(H,159,195)(H,160,200)(H,161,209)(H,162,210)(H,163,203)(H,164,199)(H,165,198)(H,166,208)(H,167,211)(H,168,212)(H,169,204)(H,170,205)(H,171,183)(H,172,191)(H,173,190)(H,174,206)(H,184,185)(H,186,187)(H4,144,145,148)(H4,146,147,149)/t73?,74-,75-,76-,77+,85-,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,107-,108-,109-,110-/m0/s1 | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 195: 535-41 (1991) Article DOI: 10.1111/j.1432-1033.1991.tb15734.x BindingDB Entry DOI: 10.7270/Q2RV0M66 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| VIP peptides (RAT) | BDBM82358 (PACAP-VIP) Show SMILES CCC(C)C(NC(=O)CNC(=O)C(CC(O)=O)NC(=O)C(CO)NC(=O)C(N)Cc1cnc[nH]1)C(=O)NC(Cc1ccccc1)C(=O)NC(C(C)O)C(=O)NC(CC(O)=O)C(=O)NC(CO)C(=O)NC(Cc1ccc(O)cc1)C(=O)NC(C(C)O)C(=O)NC(CCCN=C(N)N)C(=O)NC(CC(C)C)C(=O)NC(CCCN=C(N)N)C(=O)NC(CCCCN)C(=O)NC(CCC(N)=O)C(=O)NC(CCSC)C(=O)NC(C)C(=O)NC(C(C)C)C(=O)NC(CCCCN)C(=O)NC(CCCCN)C(=O)NC(Cc1ccc(O)cc1)C(=O)NC(CC(C)C)C(=O)NC(CC(N)=O)C(=O)NC(CO)C(=O)NC(C(C)CC)C(=O)NC(CC(C)C)C(=O)NC(CC(N)=O)C(O)=O |(25.91,-12.62,;26.68,-13.95,;25.35,-14.72,;24.02,-13.95,;25.35,-16.26,;24.02,-17.03,;22.48,-16.26,;22.48,-14.72,;21.14,-17.03,;19.81,-16.26,;18.27,-17.03,;18.27,-18.57,;16.93,-16.26,;16.93,-14.72,;18.27,-13.95,;18.27,-12.41,;19.6,-14.72,;15.6,-17.03,;14.06,-16.26,;14.06,-14.72,;12.73,-17.03,;12.73,-18.57,;14.06,-19.34,;11.39,-16.26,;9.85,-17.03,;9.85,-18.57,;8.52,-16.26,;7.19,-17.03,;8.52,-14.72,;7.19,-13.95,;7.03,-12.42,;5.52,-12.1,;4.75,-13.43,;5.78,-14.58,;26.68,-17.03,;26.68,-18.57,;28.22,-16.26,;29.56,-17.03,;29.56,-18.57,;30.89,-19.34,;30.89,-20.88,;32.22,-21.65,;33.56,-20.88,;33.56,-19.34,;32.22,-18.57,;30.89,-16.26,;30.89,-14.72,;32.43,-17.03,;33.76,-16.26,;33.76,-14.72,;32.43,-13.95,;35.1,-13.95,;35.1,-17.03,;35.1,-18.57,;35.82,-6.25,;34.49,-5.48,;34.49,-3.94,;35.82,-3.17,;35.82,-1.63,;37.15,-3.94,;33.15,-6.25,;33.15,-7.79,;31.61,-5.48,;30.28,-6.25,;30.28,-7.79,;28.95,-8.56,;28.95,-5.48,;28.95,-3.94,;27.41,-6.25,;26.07,-5.48,;26.07,-3.94,;24.74,-3.17,;24.74,-1.63,;23.4,-.86,;22.07,-1.63,;20.74,-.86,;22.07,-3.17,;23.4,-3.94,;24.74,-6.25,;24.74,-7.79,;23.2,-5.48,;21.86,-6.25,;21.86,-7.79,;23.2,-8.56,;20.53,-8.56,;20.53,-5.48,;20.53,-3.94,;18.99,-6.25,;17.66,-5.48,;17.66,-3.94,;16.32,-3.17,;16.32,-1.63,;17.66,-.86,;17.66,.68,;18.99,1.45,;16.32,1.45,;16.32,-6.25,;16.32,-7.79,;14.78,-5.48,;13.45,-6.25,;13.45,-7.79,;12.12,-8.56,;12.12,-10.1,;10.78,-7.79,;12.12,-5.48,;12.12,-3.94,;10.58,-6.25,;9.24,-5.48,;9.24,-3.94,;7.91,-3.17,;7.91,-1.63,;6.57,-.86,;5.24,-1.63,;3.91,-.86,;5.24,-3.17,;7.91,-6.25,;7.91,-7.79,;7.19,4.53,;8.52,5.3,;8.52,6.84,;7.19,7.61,;7.19,9.15,;5.85,9.92,;4.52,9.15,;9.85,4.53,;9.85,2.99,;11.39,5.3,;12.73,4.53,;12.73,2.99,;14.06,2.22,;14.06,.68,;12.73,-.09,;15.39,-.09,;14.06,5.3,;14.06,6.84,;15.6,4.53,;16.93,5.3,;16.93,6.84,;18.27,7.61,;18.27,9.15,;16.93,9.92,;18.27,4.53,;18.27,2.99,;19.81,5.3,;21.14,4.53,;21.14,2.99,;22.48,5.3,;22.48,6.84,;24.02,4.53,;25.35,5.3,;25.35,6.84,;26.68,7.61,;24.02,7.61,;26.68,4.53,;26.68,2.99,;28.22,5.3,;29.56,4.53,;29.56,2.99,;30.89,2.22,;30.89,.68,;32.22,-.09,;33.56,.68,;30.89,5.3,;30.89,6.84,;32.43,4.53,;33.76,5.3,;33.76,6.84,;35.1,7.61,;36.43,6.84,;37.77,7.61,;39.1,6.84,;35.1,4.53,;35.1,2.99,;35.82,15.31,;34.49,16.08,;34.49,17.62,;35.82,18.39,;37.15,17.62,;38.49,18.39,;38.49,19.93,;39.82,20.7,;37.15,20.7,;35.82,19.93,;33.15,15.31,;33.15,13.77,;31.61,16.08,;30.28,15.31,;30.28,13.77,;28.95,13,;28.95,11.46,;27.61,13.77,;28.95,16.08,;28.95,17.62,;27.41,15.31,;26.07,16.08,;26.07,17.62,;24.74,18.39,;24.74,19.93,;23.4,17.62,;24.74,15.31,;24.74,13.77,;23.2,16.08,;21.86,15.31,;21.86,13.77,;20.53,13,;20.53,16.08,;20.53,17.62,;18.99,15.31,;17.66,16.08,;17.66,17.62,;18.99,18.39,;16.32,18.39,;16.32,19.93,;16.32,15.31,;16.32,13.77,;14.78,16.08,;13.45,15.31,;13.45,13.77,;12.12,13,;12.12,11.46,;10.78,13.77,;12.12,16.08,;12.12,17.62,;10.58,15.31,;9.24,16.08,;9.24,17.62,;7.91,18.39,;7.91,19.93,;6.57,17.62,;7.91,15.31,;6.57,16.08,;7.91,13.77,)| Show InChI InChI=1S/C146H236N42O43S/c1-17-75(11)114(184-110(199)66-161-120(206)101(63-111(200)201)176-136(222)104(67-189)181-119(205)86(150)60-83-65-158-70-162-83)140(226)178-99(57-80-30-20-19-21-31-80)135(221)188-117(79(15)193)143(229)179-102(64-112(202)203)133(219)182-105(68-190)137(223)174-98(59-82-39-43-85(195)44-40-82)134(220)187-116(78(14)192)142(228)170-91(36-29-52-160-146(156)157)126(212)171-94(54-71(3)4)128(214)166-90(35-28-51-159-145(154)155)124(210)164-87(32-22-25-48-147)122(208)167-92(45-46-107(151)196)127(213)168-93(47-53-232-16)121(207)163-77(13)118(204)185-113(74(9)10)139(225)169-89(34-24-27-50-149)123(209)165-88(33-23-26-49-148)125(211)173-97(58-81-37-41-84(194)42-38-81)131(217)172-95(55-72(5)6)129(215)175-100(61-108(152)197)132(218)183-106(69-191)138(224)186-115(76(12)18-2)141(227)177-96(56-73(7)8)130(216)180-103(144(230)231)62-109(153)198/h19-21,30-31,37-44,65,70-79,86-106,113-117,189-195H,17-18,22-29,32-36,45-64,66-69,147-150H2,1-16H3,(H2,151,196)(H2,152,197)(H2,153,198)(H,158,162)(H,161,206)(H,163,207)(H,164,210)(H,165,209)(H,166,214)(H,167,208)(H,168,213)(H,169,225)(H,170,228)(H,171,212)(H,172,217)(H,173,211)(H,174,223)(H,175,215)(H,176,222)(H,177,227)(H,178,226)(H,179,229)(H,180,216)(H,181,205)(H,182,219)(H,183,218)(H,184,199)(H,185,204)(H,186,224)(H,187,220)(H,188,221)(H,200,201)(H,202,203)(H,230,231)(H4,154,155,159)(H4,156,157,160) | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Université Libre de Bruxelles Curated by PDSP Ki Database | Eur J Biochem 195: 535-41 (1991) Article DOI: 10.1111/j.1432-1033.1991.tb15734.x BindingDB Entry DOI: 10.7270/Q2RV0M66 | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Displayed 1 to 50 (of 122 total ) | Next | Last >> |
