Found 2 hits in this display 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 type I receptor
(Homo sapiens (Human)) | BDBM50250044
(CHEMBL524514 | [D-Thr7]PACAP27)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](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:26.26,12.16,4.4,49.52,63.64,81.83,98.100,121.124,139.142,152.155,168.171,189.193,202.207,214.218,wD:20.22,2.2,37.37,48.49,55.56,69.70,87.89,110.113,130.133,147.151,159.162,177.180,197.202,207.211,(6.73,2.78,;6.73,1.24,;8.07,.47,;9.4,1.24,;8.07,-1.07,;6.73,-1.84,;5.4,-1.07,;5.4,.47,;4.07,-1.84,;2.73,-1.07,;1.4,-1.84,;1.4,-3.38,;.07,-1.07,;.07,.47,;1.4,1.24,;2.73,.47,;1.4,2.78,;-1.27,-1.84,;-2.6,-1.07,;-2.6,.47,;-3.94,-1.84,;-3.94,-3.38,;-2.6,-4.15,;-5.27,-1.07,;-6.6,-1.84,;-6.6,-3.38,;-7.94,-1.07,;-9.27,-1.84,;-7.94,.47,;-6.6,1.24,;-5.19,.61,;-4.16,1.76,;-4.93,3.1,;-6.44,2.77,;9.4,-1.84,;9.4,-3.38,;10.74,-1.07,;12.07,-1.84,;12.07,-3.38,;13.4,-4.15,;14.74,-3.38,;16.08,-4.15,;16.08,-5.7,;14.74,-6.47,;13.4,-5.7,;13.4,-1.07,;13.4,.47,;14.74,-1.84,;16.07,-1.07,;16.07,.47,;14.74,1.24,;17.4,1.24,;17.4,-1.84,;17.4,-3.38,;18.74,-1.07,;20.07,-1.84,;20.07,-3.38,;21.4,-4.15,;22.74,-3.38,;21.4,-5.69,;21.4,-1.07,;21.4,.47,;22.74,-1.84,;24.07,-1.07,;24.07,.47,;25.41,1.24,;25.41,-1.84,;25.41,-3.38,;26.74,-1.07,;28.07,-1.84,;28.07,-3.38,;29.41,-4.15,;30.74,-3.38,;32.08,-4.15,;32.08,-5.7,;33.42,-6.47,;30.74,-6.47,;29.41,-5.7,;29.41,-1.07,;29.41,.47,;30.74,-1.84,;32.07,-1.07,;32.07,.47,;33.41,1.24,;33.41,-1.84,;33.41,-3.38,;34.74,-1.07,;36.07,-1.84,;36.07,-3.38,;37.41,-4.15,;37.41,-5.69,;38.74,-6.46,;38.74,-8,;37.41,-8.77,;40.08,-8.77,;37.41,-1.07,;37.41,.47,;38.74,-1.84,;40.08,-1.07,;40.08,.47,;41.41,1.24,;42.75,.46,;44.09,1.24,;44.09,2.78,;45.42,3.55,;42.75,3.56,;41.41,2.78,;41.41,-1.84,;41.41,-3.38,;42.74,-1.07,;44.08,-1.84,;44.08,-3.38,;45.41,-4.15,;45.41,-5.69,;46.74,-6.46,;46.74,-8,;45.41,-8.77,;48.08,-8.77,;45.41,-1.07,;45.41,.47,;46.74,-1.84,;48.08,-1.07,;48.08,.47,;49.41,1.24,;49.41,2.78,;50.74,3.55,;50.74,5.09,;49.41,-1.84,;49.41,-3.38,;50.74,-1.07,;52.08,-1.84,;52.08,-3.38,;53.41,-4.15,;53.41,-5.69,;52.08,-6.46,;54.75,-6.46,;53.41,-1.07,;53.41,.47,;54.75,-1.84,;56.08,-1.07,;56.08,.47,;57.41,1.24,;57.41,2.78,;58.75,3.55,;57.41,-1.84,;57.41,-3.38,;58.75,-1.07,;60.08,-1.84,;60.08,-3.38,;61.41,-1.07,;61.41,.47,;62.75,-1.84,;64.08,-1.07,;64.08,.47,;65.41,1.24,;62.75,1.24,;65.41,-1.84,;65.41,-3.38,;66.75,-1.07,;68.08,-1.84,;68.08,-3.38,;69.42,-4.15,;69.42,-5.69,;70.75,-6.46,;70.75,-8,;69.42,-1.07,;69.42,.47,;70.75,-1.84,;72.08,-1.07,;72.08,.47,;73.42,1.24,;73.42,2.78,;74.75,3.55,;74.75,5.09,;73.42,-1.84,;73.42,-3.38,;74.75,-1.07,;76.08,-1.84,;76.08,-3.38,;77.42,-4.15,;78.76,-3.38,;80.09,-4.15,;80.09,-5.7,;81.43,-6.47,;78.76,-6.47,;77.42,-5.7,;77.42,-1.07,;77.42,.47,;78.75,-1.84,;80.09,-1.07,;80.09,.47,;81.42,1.24,;81.42,2.78,;82.75,.47,;81.42,-1.84,;81.42,-3.38,;82.75,-1.07,;84.09,-1.84,;84.09,-3.38,;85.42,-1.07,;85.42,.47,;86.75,-1.84,;88.09,-1.07,;88.09,.47,;89.42,-1.84,;89.42,-3.38,;90.75,-1.07,;92.09,-1.84,;92.09,-3.38,;93.42,-4.15,;90.75,-4.15,;93.42,-1.07,;93.42,.47,;94.76,-1.84,;96.09,-1.07,;96.09,.47,;97.42,1.24,;97.42,2.78,;98.76,.47,;97.42,-1.84,;98.76,-1.07,;97.42,-3.38,)| Show InChI InChI=1S/C142H224N40O39S/c1-16-75(10)113(179-108(191)66-156-120(201)102(63-109(192)193)173-135(216)104(67-183)176-119(200)88(146)62-84-65-153-70-157-84)139(220)174-101(58-80-28-18-17-19-29-80)133(214)182-114(79(14)186)140(221)175-103(64-110(194)195)132(213)178-106(69-185)136(217)172-100(61-83-39-45-87(189)46-40-83)131(212)177-105(68-184)134(215)164-93(34-27-54-155-142(151)152)126(207)170-98(59-81-35-41-85(187)42-36-81)129(210)163-92(33-26-53-154-141(149)150)124(205)161-89(30-20-23-50-143)122(203)165-94(47-48-107(147)190)127(208)166-95(49-55-222-15)121(202)159-78(13)118(199)180-111(73(6)7)137(218)167-91(32-22-25-52-145)123(204)162-90(31-21-24-51-144)125(206)171-99(60-82-37-43-86(188)44-38-82)130(211)169-97(57-72(4)5)128(209)160-76(11)116(197)158-77(12)117(198)181-112(74(8)9)138(219)168-96(115(148)196)56-71(2)3/h17-19,28-29,35-46,65,70-79,88-106,111-114,183-189H,16,20-27,30-34,47-64,66-69,143-146H2,1-15H3,(H2,147,190)(H2,148,196)(H,153,157)(H,156,201)(H,158,197)(H,159,202)(H,160,209)(H,161,205)(H,162,204)(H,163,210)(H,164,215)(H,165,203)(H,166,208)(H,167,218)(H,168,219)(H,169,211)(H,170,207)(H,171,206)(H,172,217)(H,173,216)(H,174,220)(H,175,221)(H,176,200)(H,177,212)(H,178,213)(H,179,191)(H,180,199)(H,181,198)(H,182,214)(H,192,193)(H,194,195)(H4,149,150,154)(H4,151,152,155)/t75-,76-,77-,78-,79+,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,111-,112-,113-,114+/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.41E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institut National de la Recherche Scientifique
Curated by ChEMBL
| Assay Description
Displacement of [125I]Ac-PACAP27 from human recombinant PAC1 receptor expressed in CHO cells by gamma- counter |
J Med Chem 52: 3308-16 (2009)
Article DOI: 10.1021/jm900291j
BindingDB Entry DOI: 10.7270/Q29023PC |
More data for this
Ligand-Target Pair | |
Pituitary adenylate cyclase-activating polypeptide type I receptor
(Homo sapiens (Human)) | BDBM50250044
(CHEMBL524514 | [D-Thr7]PACAP27)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](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:26.26,12.16,4.4,49.52,63.64,81.83,98.100,121.124,139.142,152.155,168.171,189.193,202.207,214.218,wD:20.22,2.2,37.37,48.49,55.56,69.70,87.89,110.113,130.133,147.151,159.162,177.180,197.202,207.211,(6.73,2.78,;6.73,1.24,;8.07,.47,;9.4,1.24,;8.07,-1.07,;6.73,-1.84,;5.4,-1.07,;5.4,.47,;4.07,-1.84,;2.73,-1.07,;1.4,-1.84,;1.4,-3.38,;.07,-1.07,;.07,.47,;1.4,1.24,;2.73,.47,;1.4,2.78,;-1.27,-1.84,;-2.6,-1.07,;-2.6,.47,;-3.94,-1.84,;-3.94,-3.38,;-2.6,-4.15,;-5.27,-1.07,;-6.6,-1.84,;-6.6,-3.38,;-7.94,-1.07,;-9.27,-1.84,;-7.94,.47,;-6.6,1.24,;-5.19,.61,;-4.16,1.76,;-4.93,3.1,;-6.44,2.77,;9.4,-1.84,;9.4,-3.38,;10.74,-1.07,;12.07,-1.84,;12.07,-3.38,;13.4,-4.15,;14.74,-3.38,;16.08,-4.15,;16.08,-5.7,;14.74,-6.47,;13.4,-5.7,;13.4,-1.07,;13.4,.47,;14.74,-1.84,;16.07,-1.07,;16.07,.47,;14.74,1.24,;17.4,1.24,;17.4,-1.84,;17.4,-3.38,;18.74,-1.07,;20.07,-1.84,;20.07,-3.38,;21.4,-4.15,;22.74,-3.38,;21.4,-5.69,;21.4,-1.07,;21.4,.47,;22.74,-1.84,;24.07,-1.07,;24.07,.47,;25.41,1.24,;25.41,-1.84,;25.41,-3.38,;26.74,-1.07,;28.07,-1.84,;28.07,-3.38,;29.41,-4.15,;30.74,-3.38,;32.08,-4.15,;32.08,-5.7,;33.42,-6.47,;30.74,-6.47,;29.41,-5.7,;29.41,-1.07,;29.41,.47,;30.74,-1.84,;32.07,-1.07,;32.07,.47,;33.41,1.24,;33.41,-1.84,;33.41,-3.38,;34.74,-1.07,;36.07,-1.84,;36.07,-3.38,;37.41,-4.15,;37.41,-5.69,;38.74,-6.46,;38.74,-8,;37.41,-8.77,;40.08,-8.77,;37.41,-1.07,;37.41,.47,;38.74,-1.84,;40.08,-1.07,;40.08,.47,;41.41,1.24,;42.75,.46,;44.09,1.24,;44.09,2.78,;45.42,3.55,;42.75,3.56,;41.41,2.78,;41.41,-1.84,;41.41,-3.38,;42.74,-1.07,;44.08,-1.84,;44.08,-3.38,;45.41,-4.15,;45.41,-5.69,;46.74,-6.46,;46.74,-8,;45.41,-8.77,;48.08,-8.77,;45.41,-1.07,;45.41,.47,;46.74,-1.84,;48.08,-1.07,;48.08,.47,;49.41,1.24,;49.41,2.78,;50.74,3.55,;50.74,5.09,;49.41,-1.84,;49.41,-3.38,;50.74,-1.07,;52.08,-1.84,;52.08,-3.38,;53.41,-4.15,;53.41,-5.69,;52.08,-6.46,;54.75,-6.46,;53.41,-1.07,;53.41,.47,;54.75,-1.84,;56.08,-1.07,;56.08,.47,;57.41,1.24,;57.41,2.78,;58.75,3.55,;57.41,-1.84,;57.41,-3.38,;58.75,-1.07,;60.08,-1.84,;60.08,-3.38,;61.41,-1.07,;61.41,.47,;62.75,-1.84,;64.08,-1.07,;64.08,.47,;65.41,1.24,;62.75,1.24,;65.41,-1.84,;65.41,-3.38,;66.75,-1.07,;68.08,-1.84,;68.08,-3.38,;69.42,-4.15,;69.42,-5.69,;70.75,-6.46,;70.75,-8,;69.42,-1.07,;69.42,.47,;70.75,-1.84,;72.08,-1.07,;72.08,.47,;73.42,1.24,;73.42,2.78,;74.75,3.55,;74.75,5.09,;73.42,-1.84,;73.42,-3.38,;74.75,-1.07,;76.08,-1.84,;76.08,-3.38,;77.42,-4.15,;78.76,-3.38,;80.09,-4.15,;80.09,-5.7,;81.43,-6.47,;78.76,-6.47,;77.42,-5.7,;77.42,-1.07,;77.42,.47,;78.75,-1.84,;80.09,-1.07,;80.09,.47,;81.42,1.24,;81.42,2.78,;82.75,.47,;81.42,-1.84,;81.42,-3.38,;82.75,-1.07,;84.09,-1.84,;84.09,-3.38,;85.42,-1.07,;85.42,.47,;86.75,-1.84,;88.09,-1.07,;88.09,.47,;89.42,-1.84,;89.42,-3.38,;90.75,-1.07,;92.09,-1.84,;92.09,-3.38,;93.42,-4.15,;90.75,-4.15,;93.42,-1.07,;93.42,.47,;94.76,-1.84,;96.09,-1.07,;96.09,.47,;97.42,1.24,;97.42,2.78,;98.76,.47,;97.42,-1.84,;98.76,-1.07,;97.42,-3.38,)| Show InChI InChI=1S/C142H224N40O39S/c1-16-75(10)113(179-108(191)66-156-120(201)102(63-109(192)193)173-135(216)104(67-183)176-119(200)88(146)62-84-65-153-70-157-84)139(220)174-101(58-80-28-18-17-19-29-80)133(214)182-114(79(14)186)140(221)175-103(64-110(194)195)132(213)178-106(69-185)136(217)172-100(61-83-39-45-87(189)46-40-83)131(212)177-105(68-184)134(215)164-93(34-27-54-155-142(151)152)126(207)170-98(59-81-35-41-85(187)42-36-81)129(210)163-92(33-26-53-154-141(149)150)124(205)161-89(30-20-23-50-143)122(203)165-94(47-48-107(147)190)127(208)166-95(49-55-222-15)121(202)159-78(13)118(199)180-111(73(6)7)137(218)167-91(32-22-25-52-145)123(204)162-90(31-21-24-51-144)125(206)171-99(60-82-37-43-86(188)44-38-82)130(211)169-97(57-72(4)5)128(209)160-76(11)116(197)158-77(12)117(198)181-112(74(8)9)138(219)168-96(115(148)196)56-71(2)3/h17-19,28-29,35-46,65,70-79,88-106,111-114,183-189H,16,20-27,30-34,47-64,66-69,143-146H2,1-15H3,(H2,147,190)(H2,148,196)(H,153,157)(H,156,201)(H,158,197)(H,159,202)(H,160,209)(H,161,205)(H,162,204)(H,163,210)(H,164,215)(H,165,203)(H,166,208)(H,167,218)(H,168,219)(H,169,211)(H,170,207)(H,171,206)(H,172,217)(H,173,216)(H,174,220)(H,175,221)(H,176,200)(H,177,212)(H,178,213)(H,179,191)(H,180,199)(H,181,198)(H,182,214)(H,192,193)(H,194,195)(H4,149,150,154)(H4,151,152,155)/t75-,76-,77-,78-,79+,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,111-,112-,113-,114+/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 141 | n/a | n/a | n/a | n/a |
Institut National de la Recherche Scientifique
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant PAC1 receptor expressed in CHO cells assessed as PACAP38-induced calcium mobilization by FLIPR assay |
J Med Chem 52: 3308-16 (2009)
Article DOI: 10.1021/jm900291j
BindingDB Entry DOI: 10.7270/Q29023PC |
More data for this
Ligand-Target Pair | |