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PubMed code 8632403

Compile data set for download or QSAR
Found 14 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Neuropeptide Y receptor type 1


(Homo sapiens (Human))
BDBM50049745
PNG
(CHEMBL439307 | NPY-analogs)
Show SMILES CCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](NC(=O)[C@H](CSSC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O
Show InChI InChI=1S/C116H186N36O28S2/c1-13-21-73(97(165)137-75(23-17-43-131-113(123)124)101(169)141-79(93(121)161)51-65-31-39-69(157)40-32-65)135-99(167)77(25-19-45-133-115(127)128)139-111(179)91(61(11)153)151-107(175)85(147-103(171)81(47-57(5)6)143-105(173)83(53-87(119)159)145-109(177)89(59(9)15-3)149-95(163)71(117)49-63-27-35-67(155)36-28-63)55-181-182-56-86(148-104(172)82(48-58(7)8)144-106(174)84(54-88(120)160)146-110(178)90(60(10)16-4)150-96(164)72(118)50-64-29-37-68(156)38-30-64)108(176)152-92(62(12)154)112(180)140-78(26-20-46-134-116(129)130)100(168)136-74(22-14-2)98(166)138-76(24-18-44-132-114(125)126)102(170)142-80(94(122)162)52-66-33-41-70(158)42-34-66/h27-42,57-62,71-86,89-92,153-158H,13-26,43-56,117-118H2,1-12H3,(H2,119,159)(H2,120,160)(H2,121,161)(H2,122,162)(H,135,167)(H,136,168)(H,137,165)(H,138,166)(H,139,179)(H,140,180)(H,141,169)(H,142,170)(H,143,173)(H,144,174)(H,145,177)(H,146,178)(H,147,171)(H,148,172)(H,149,163)(H,150,164)(H,151,175)(H,152,176)(H4,123,124,131)(H4,125,126,132)(H4,127,128,133)(H4,129,130,134)/t59-,60-,61+,62+,71-,72-,73-,74-,75-,76-,77-,78-,79-,80-,81-,82-,83-,84-,85-,86-,89-,90-,91-,92-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
36n/an/an/an/an/an/an/an/a



University of Cincinnati Medical Center

Curated by ChEMBL


Assay Description
Compound was tested for the displacement of [125I]-PYY (SK-N-MC) from Neuropeptide Y receptor type 1 in the membranes prepared from cells


J Med Chem 39: 811-3 (1996)


Article DOI: 10.1021/jm950811r
BindingDB Entry DOI: 10.7270/Q2FB5218
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))
BDBM50049742
PNG
(CHEMBL265426 | NPY-analogs)
Show SMILES CCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)CC)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O
Show InChI InChI=1S/C130H192N38O26S2/c1-11-23-87(111(179)153-91(31-21-51-147-129(141)142)115(183)157-93(107(135)175)57-73-37-45-79(171)46-38-73)151-113(181)89(29-19-49-145-127(137)138)155-119(187)97(59-75-63-149-85-27-17-15-25-81(75)85)161-123(191)101(165-117(185)95(53-67(5)6)159-121(189)99(61-103(133)173)163-125(193)105(69(9)13-3)167-109(177)83(131)55-71-33-41-77(169)42-34-71)65-195-196-66-102(166-118(186)96(54-68(7)8)160-122(190)100(62-104(134)174)164-126(194)106(70(10)14-4)168-110(178)84(132)56-72-35-43-78(170)44-36-72)124(192)162-98(60-76-64-150-86-28-18-16-26-82(76)86)120(188)156-90(30-20-50-146-128(139)140)114(182)152-88(24-12-2)112(180)154-92(32-22-52-148-130(143)144)116(184)158-94(108(136)176)58-74-39-47-80(172)48-40-74/h15-18,25-28,33-48,63-64,67-70,83-84,87-102,105-106,149-150,169-172H,11-14,19-24,29-32,49-62,65-66,131-132H2,1-10H3,(H2,133,173)(H2,134,174)(H2,135,175)(H2,136,176)(H,151,181)(H,152,182)(H,153,179)(H,154,180)(H,155,187)(H,156,188)(H,157,183)(H,158,184)(H,159,189)(H,160,190)(H,161,191)(H,162,192)(H,163,193)(H,164,194)(H,165,185)(H,166,186)(H,167,177)(H,168,178)(H4,137,138,145)(H4,139,140,146)(H4,141,142,147)(H4,143,144,148)/t69-,70-,83-,84-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,105-,106-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
44n/an/an/an/an/an/an/an/a



University of Cincinnati Medical Center

Curated by ChEMBL


Assay Description
Compound was tested for the displacement of [125I]-PYY (SK-N-MC) from Neuropeptide Y receptor type 1 in the membranes prepared from cells


J Med Chem 39: 811-3 (1996)


Article DOI: 10.1021/jm950811r
BindingDB Entry DOI: 10.7270/Q2FB5218
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))
BDBM50049744
PNG
(CHEMBL438548 | NPY-analogs | [Cys-Trp-Arg-Nva-Arg-...)
Show SMILES CCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CSSC[C@H](N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O
Show InChI InChI=1S/C80H118N28O14S2/c1-3-13-55(69(115)101-59(21-11-33-95-79(89)90)73(119)105-61(65(83)111)35-43-23-27-47(109)28-24-43)99-71(117)57(19-9-31-93-77(85)86)103-75(121)63(37-45-39-97-53-17-7-5-15-49(45)53)107-67(113)51(81)41-123-124-42-52(82)68(114)108-64(38-46-40-98-54-18-8-6-16-50(46)54)76(122)104-58(20-10-32-94-78(87)88)72(118)100-56(14-4-2)70(116)102-60(22-12-34-96-80(91)92)74(120)106-62(66(84)112)36-44-25-29-48(110)30-26-44/h5-8,15-18,23-30,39-40,51-52,55-64,97-98,109-110H,3-4,9-14,19-22,31-38,41-42,81-82H2,1-2H3,(H2,83,111)(H2,84,112)(H,99,117)(H,100,118)(H,101,115)(H,102,116)(H,103,121)(H,104,122)(H,105,119)(H,106,120)(H,107,113)(H,108,114)(H4,85,86,93)(H4,87,88,94)(H4,89,90,95)(H4,91,92,96)/t51-,52-,55-,56-,57-,58-,59-,60-,61-,62-,63-,64-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
46n/an/an/an/an/an/an/an/a



University of Cincinnati Medical Center

Curated by ChEMBL


Assay Description
Compound was tested for the displacement of [125I]-PYY (SK-N-MC) from Neuropeptide Y receptor type 1 in the membranes prepared from cells


J Med Chem 39: 811-3 (1996)


Article DOI: 10.1021/jm950811r
BindingDB Entry DOI: 10.7270/Q2FB5218
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))
BDBM50049741
PNG
(CHEMBL429071 | NPY-analogs)
Show SMILES CCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](NC(=O)[C@H](CSSC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O
Show InChI InChI=1S/C108H174N32O24S2/c1-13-21-71(91(151)127-73(23-17-43-121-105(113)114)95(155)131-77(87(111)147)51-63-31-39-67(145)40-32-63)125-93(153)75(25-19-45-123-107(117)118)129-103(163)85(59(11)141)139-99(159)81(135-97(157)79(47-55(5)6)133-101(161)83(57(9)15-3)137-89(149)69(109)49-61-27-35-65(143)36-28-61)53-165-166-54-82(136-98(158)80(48-56(7)8)134-102(162)84(58(10)16-4)138-90(150)70(110)50-62-29-37-66(144)38-30-62)100(160)140-86(60(12)142)104(164)130-76(26-20-46-124-108(119)120)94(154)126-72(22-14-2)92(152)128-74(24-18-44-122-106(115)116)96(156)132-78(88(112)148)52-64-33-41-68(146)42-34-64/h27-42,55-60,69-86,141-146H,13-26,43-54,109-110H2,1-12H3,(H2,111,147)(H2,112,148)(H,125,153)(H,126,154)(H,127,151)(H,128,152)(H,129,163)(H,130,164)(H,131,155)(H,132,156)(H,133,161)(H,134,162)(H,135,157)(H,136,158)(H,137,149)(H,138,150)(H,139,159)(H,140,160)(H4,113,114,121)(H4,115,116,122)(H4,117,118,123)(H4,119,120,124)/t57-,58-,59+,60+,69-,70-,71-,72-,73-,74-,75-,76-,77-,78-,79-,80-,81-,82-,83-,84-,85-,86-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
49n/an/an/an/an/an/an/an/a



University of Cincinnati Medical Center

Curated by ChEMBL


Assay Description
Compound was tested for the displacement of [125I]-PYY (SK-N-MC) from Neuropeptide Y receptor type 1 in the membranes prepared from cells


J Med Chem 39: 811-3 (1996)


Article DOI: 10.1021/jm950811r
BindingDB Entry DOI: 10.7270/Q2FB5218
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))
BDBM50049743
PNG
(CHEMBL410780 | NPY-analogs)
Show SMILES CCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O
Show InChI InChI=1S/C132H178N36O22S2/c1-7-21-95(115(177)155-99(33-19-53-147-131(141)142)119(181)159-101(111(135)173)59-75-39-47-83(171)48-40-75)153-117(179)97(31-17-51-145-129(137)138)157-123(185)107(63-79-67-151-93-29-15-11-25-87(79)93)165-127(189)109(167-121(183)103(55-71(3)4)163-125(187)105(61-77-65-149-91-27-13-9-23-85(77)91)161-113(175)89(133)57-73-35-43-81(169)44-36-73)69-191-192-70-110(168-122(184)104(56-72(5)6)164-126(188)106(62-78-66-150-92-28-14-10-24-86(78)92)162-114(176)90(134)58-74-37-45-82(170)46-38-74)128(190)166-108(64-80-68-152-94-30-16-12-26-88(80)94)124(186)158-98(32-18-52-146-130(139)140)118(180)154-96(22-8-2)116(178)156-100(34-20-54-148-132(143)144)120(182)160-102(112(136)174)60-76-41-49-84(172)50-42-76/h9-16,23-30,35-50,65-68,71-72,89-90,95-110,149-152,169-172H,7-8,17-22,31-34,51-64,69-70,133-134H2,1-6H3,(H2,135,173)(H2,136,174)(H,153,179)(H,154,180)(H,155,177)(H,156,178)(H,157,185)(H,158,186)(H,159,181)(H,160,182)(H,161,175)(H,162,176)(H,163,187)(H,164,188)(H,165,189)(H,166,190)(H,167,183)(H,168,184)(H4,137,138,145)(H4,139,140,146)(H4,141,142,147)(H4,143,144,148)/t89-,90-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
93n/an/an/an/an/an/an/an/a



University of Cincinnati Medical Center

Curated by ChEMBL


Assay Description
Compound was tested for the displacement of [125I]-PYY (SK-N-MC) from Neuropeptide Y receptor type 1 in the membranes prepared from cells


J Med Chem 39: 811-3 (1996)


Article DOI: 10.1021/jm950811r
BindingDB Entry DOI: 10.7270/Q2FB5218
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))
BDBM50049746
PNG
(CHEMBL441204 | NPY-analogs)
Show SMILES CCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)CC)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O
Show InChI InChI=1S/C122H180N34O22S2/c1-11-23-85(105(165)143-89(31-21-51-137-121(131)132)109(169)147-91(101(125)161)57-71-37-45-77(159)46-38-71)141-107(167)87(29-19-49-135-119(127)128)145-113(173)95(59-73-61-139-83-27-17-15-25-79(73)83)149-115(175)97(153-111(171)93(53-65(5)6)151-117(177)99(67(9)13-3)155-103(163)81(123)55-69-33-41-75(157)42-34-69)63-179-180-64-98(154-112(172)94(54-66(7)8)152-118(178)100(68(10)14-4)156-104(164)82(124)56-70-35-43-76(158)44-36-70)116(176)150-96(60-74-62-140-84-28-18-16-26-80(74)84)114(174)146-88(30-20-50-136-120(129)130)108(168)142-86(24-12-2)106(166)144-90(32-22-52-138-122(133)134)110(170)148-92(102(126)162)58-72-39-47-78(160)48-40-72/h15-18,25-28,33-48,61-62,65-68,81-82,85-100,139-140,157-160H,11-14,19-24,29-32,49-60,63-64,123-124H2,1-10H3,(H2,125,161)(H2,126,162)(H,141,167)(H,142,168)(H,143,165)(H,144,166)(H,145,173)(H,146,174)(H,147,169)(H,148,170)(H,149,175)(H,150,176)(H,151,177)(H,152,178)(H,153,171)(H,154,172)(H,155,163)(H,156,164)(H4,127,128,135)(H4,129,130,136)(H4,131,132,137)(H4,133,134,138)/t67-,68-,81-,82-,85-,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
95n/an/an/an/an/an/an/an/a



University of Cincinnati Medical Center

Curated by ChEMBL


Assay Description
Compound was tested for the displacement of [125I]-PYY (SK-N-MC) from Neuropeptide Y receptor type 1 in the membranes prepared from cells


J Med Chem 39: 811-3 (1996)


Article DOI: 10.1021/jm950811r
BindingDB Entry DOI: 10.7270/Q2FB5218
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))
BDBM50408041
PNG
(CHEMBL2110196)
Show SMILES CCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O
Show InChI InChI=1S/C132H178N36O22S2/c1-7-21-95(115(177)155-99(33-19-53-147-131(141)142)119(181)159-101(111(135)173)59-75-39-47-83(171)48-40-75)153-117(179)97(31-17-51-145-129(137)138)157-123(185)107(63-79-67-151-93-29-15-11-25-87(79)93)165-127(189)109(167-121(183)103(55-71(3)4)163-125(187)105(61-77-65-149-91-27-13-9-23-85(77)91)161-113(175)89(133)57-73-35-43-81(169)44-36-73)69-191-192-70-110(168-122(184)104(56-72(5)6)164-126(188)106(62-78-66-150-92-28-14-10-24-86(78)92)162-114(176)90(134)58-74-37-45-82(170)46-38-74)128(190)166-108(64-80-68-152-94-30-16-12-26-88(80)94)124(186)158-98(32-18-52-146-130(139)140)118(180)154-96(22-8-2)116(178)156-100(34-20-54-148-132(143)144)120(182)160-102(112(136)174)60-76-41-49-84(172)50-42-76/h9-16,23-30,35-50,65-68,71-72,89-90,95-110,149-152,169-172H,7-8,17-22,31-34,51-64,69-70,133-134H2,1-6H3,(H2,135,173)(H2,136,174)(H,153,179)(H,154,180)(H,155,177)(H,156,178)(H,157,185)(H,158,186)(H,159,181)(H,160,182)(H,161,175)(H,162,176)(H,163,187)(H,164,188)(H,165,189)(H,166,190)(H,167,183)(H,168,184)(H4,137,138,145)(H4,139,140,146)(H4,141,142,147)(H4,143,144,148)/t89-,90-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107+,108+,109-,110-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
143n/an/an/an/an/an/an/an/a



University of Cincinnati Medical Center

Curated by ChEMBL


Assay Description
Compound was tested for the displacement of [125I]-PYY (SK-N-MC) from Neuropeptide Y receptor type 1 in the membranes prepared from cells


J Med Chem 39: 811-3 (1996)


Article DOI: 10.1021/jm950811r
BindingDB Entry DOI: 10.7270/Q2FB5218
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 2


(Homo sapiens (Human))
BDBM50049743
PNG
(CHEMBL410780 | NPY-analogs)
Show SMILES CCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O
Show InChI InChI=1S/C132H178N36O22S2/c1-7-21-95(115(177)155-99(33-19-53-147-131(141)142)119(181)159-101(111(135)173)59-75-39-47-83(171)48-40-75)153-117(179)97(31-17-51-145-129(137)138)157-123(185)107(63-79-67-151-93-29-15-11-25-87(79)93)165-127(189)109(167-121(183)103(55-71(3)4)163-125(187)105(61-77-65-149-91-27-13-9-23-85(77)91)161-113(175)89(133)57-73-35-43-81(169)44-36-73)69-191-192-70-110(168-122(184)104(56-72(5)6)164-126(188)106(62-78-66-150-92-28-14-10-24-86(78)92)162-114(176)90(134)58-74-37-45-82(170)46-38-74)128(190)166-108(64-80-68-152-94-30-16-12-26-88(80)94)124(186)158-98(32-18-52-146-130(139)140)118(180)154-96(22-8-2)116(178)156-100(34-20-54-148-132(143)144)120(182)160-102(112(136)174)60-76-41-49-84(172)50-42-76/h9-16,23-30,35-50,65-68,71-72,89-90,95-110,149-152,169-172H,7-8,17-22,31-34,51-64,69-70,133-134H2,1-6H3,(H2,135,173)(H2,136,174)(H,153,179)(H,154,180)(H,155,177)(H,156,178)(H,157,185)(H,158,186)(H,159,181)(H,160,182)(H,161,175)(H,162,176)(H,163,187)(H,164,188)(H,165,189)(H,166,190)(H,167,183)(H,168,184)(H4,137,138,145)(H4,139,140,146)(H4,141,142,147)(H4,143,144,148)/t89-,90-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
621n/an/an/an/an/an/an/an/a



University of Cincinnati Medical Center

Curated by ChEMBL


Assay Description
Compound was tested for the displacement of [125I]-PYY(3-36) (SK-N-BE2) from Neuropeptide Y receptor type 2 in the membranes prepared from cells


J Med Chem 39: 811-3 (1996)


Article DOI: 10.1021/jm950811r
BindingDB Entry DOI: 10.7270/Q2FB5218
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 2


(Homo sapiens (Human))
BDBM50408041
PNG
(CHEMBL2110196)
Show SMILES CCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O
Show InChI InChI=1S/C132H178N36O22S2/c1-7-21-95(115(177)155-99(33-19-53-147-131(141)142)119(181)159-101(111(135)173)59-75-39-47-83(171)48-40-75)153-117(179)97(31-17-51-145-129(137)138)157-123(185)107(63-79-67-151-93-29-15-11-25-87(79)93)165-127(189)109(167-121(183)103(55-71(3)4)163-125(187)105(61-77-65-149-91-27-13-9-23-85(77)91)161-113(175)89(133)57-73-35-43-81(169)44-36-73)69-191-192-70-110(168-122(184)104(56-72(5)6)164-126(188)106(62-78-66-150-92-28-14-10-24-86(78)92)162-114(176)90(134)58-74-37-45-82(170)46-38-74)128(190)166-108(64-80-68-152-94-30-16-12-26-88(80)94)124(186)158-98(32-18-52-146-130(139)140)118(180)154-96(22-8-2)116(178)156-100(34-20-54-148-132(143)144)120(182)160-102(112(136)174)60-76-41-49-84(172)50-42-76/h9-16,23-30,35-50,65-68,71-72,89-90,95-110,149-152,169-172H,7-8,17-22,31-34,51-64,69-70,133-134H2,1-6H3,(H2,135,173)(H2,136,174)(H,153,179)(H,154,180)(H,155,177)(H,156,178)(H,157,185)(H,158,186)(H,159,181)(H,160,182)(H,161,175)(H,162,176)(H,163,187)(H,164,188)(H,165,189)(H,166,190)(H,167,183)(H,168,184)(H4,137,138,145)(H4,139,140,146)(H4,141,142,147)(H4,143,144,148)/t89-,90-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107+,108+,109-,110-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
704n/an/an/an/an/an/an/an/a



University of Cincinnati Medical Center

Curated by ChEMBL


Assay Description
Compound was tested for the displacement of [125I]-PYY(3-36) (SK-N-BE2) from Neuropeptide Y receptor type 2 in the membranes prepared from cells


J Med Chem 39: 811-3 (1996)


Article DOI: 10.1021/jm950811r
BindingDB Entry DOI: 10.7270/Q2FB5218
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 2


(Homo sapiens (Human))
BDBM50049746
PNG
(CHEMBL441204 | NPY-analogs)
Show SMILES CCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)CC)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O
Show InChI InChI=1S/C122H180N34O22S2/c1-11-23-85(105(165)143-89(31-21-51-137-121(131)132)109(169)147-91(101(125)161)57-71-37-45-77(159)46-38-71)141-107(167)87(29-19-49-135-119(127)128)145-113(173)95(59-73-61-139-83-27-17-15-25-79(73)83)149-115(175)97(153-111(171)93(53-65(5)6)151-117(177)99(67(9)13-3)155-103(163)81(123)55-69-33-41-75(157)42-34-69)63-179-180-64-98(154-112(172)94(54-66(7)8)152-118(178)100(68(10)14-4)156-104(164)82(124)56-70-35-43-76(158)44-36-70)116(176)150-96(60-74-62-140-84-28-18-16-26-80(74)84)114(174)146-88(30-20-50-136-120(129)130)108(168)142-86(24-12-2)106(166)144-90(32-22-52-138-122(133)134)110(170)148-92(102(126)162)58-72-39-47-78(160)48-40-72/h15-18,25-28,33-48,61-62,65-68,81-82,85-100,139-140,157-160H,11-14,19-24,29-32,49-60,63-64,123-124H2,1-10H3,(H2,125,161)(H2,126,162)(H,141,167)(H,142,168)(H,143,165)(H,144,166)(H,145,173)(H,146,174)(H,147,169)(H,148,170)(H,149,175)(H,150,176)(H,151,177)(H,152,178)(H,153,171)(H,154,172)(H,155,163)(H,156,164)(H4,127,128,135)(H4,129,130,136)(H4,131,132,137)(H4,133,134,138)/t67-,68-,81-,82-,85-,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
988n/an/an/an/an/an/an/an/a



University of Cincinnati Medical Center

Curated by ChEMBL


Assay Description
Compound was tested for the displacement of [125I]-PYY(3-36) (SK-N-BE2) from Neuropeptide Y receptor type 2 in the membranes prepared from cells


J Med Chem 39: 811-3 (1996)


Article DOI: 10.1021/jm950811r
BindingDB Entry DOI: 10.7270/Q2FB5218
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 2


(Homo sapiens (Human))
BDBM50049745
PNG
(CHEMBL439307 | NPY-analogs)
Show SMILES CCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](NC(=O)[C@H](CSSC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O
Show InChI InChI=1S/C116H186N36O28S2/c1-13-21-73(97(165)137-75(23-17-43-131-113(123)124)101(169)141-79(93(121)161)51-65-31-39-69(157)40-32-65)135-99(167)77(25-19-45-133-115(127)128)139-111(179)91(61(11)153)151-107(175)85(147-103(171)81(47-57(5)6)143-105(173)83(53-87(119)159)145-109(177)89(59(9)15-3)149-95(163)71(117)49-63-27-35-67(155)36-28-63)55-181-182-56-86(148-104(172)82(48-58(7)8)144-106(174)84(54-88(120)160)146-110(178)90(60(10)16-4)150-96(164)72(118)50-64-29-37-68(156)38-30-64)108(176)152-92(62(12)154)112(180)140-78(26-20-46-134-116(129)130)100(168)136-74(22-14-2)98(166)138-76(24-18-44-132-114(125)126)102(170)142-80(94(122)162)52-66-33-41-70(158)42-34-66/h27-42,57-62,71-86,89-92,153-158H,13-26,43-56,117-118H2,1-12H3,(H2,119,159)(H2,120,160)(H2,121,161)(H2,122,162)(H,135,167)(H,136,168)(H,137,165)(H,138,166)(H,139,179)(H,140,180)(H,141,169)(H,142,170)(H,143,173)(H,144,174)(H,145,177)(H,146,178)(H,147,171)(H,148,172)(H,149,163)(H,150,164)(H,151,175)(H,152,176)(H4,123,124,131)(H4,125,126,132)(H4,127,128,133)(H4,129,130,134)/t59-,60-,61+,62+,71-,72-,73-,74-,75-,76-,77-,78-,79-,80-,81-,82-,83-,84-,85-,86-,89-,90-,91-,92-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
2.09E+3n/an/an/an/an/an/an/an/a



University of Cincinnati Medical Center

Curated by ChEMBL


Assay Description
Compound was tested for the displacement of [125I]-PYY(3-36) (SK-N-BE2) from Neuropeptide Y receptor type 2 in the membranes prepared from cells


J Med Chem 39: 811-3 (1996)


Article DOI: 10.1021/jm950811r
BindingDB Entry DOI: 10.7270/Q2FB5218
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 2


(Homo sapiens (Human))
BDBM50049742
PNG
(CHEMBL265426 | NPY-analogs)
Show SMILES CCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)CC)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O
Show InChI InChI=1S/C130H192N38O26S2/c1-11-23-87(111(179)153-91(31-21-51-147-129(141)142)115(183)157-93(107(135)175)57-73-37-45-79(171)46-38-73)151-113(181)89(29-19-49-145-127(137)138)155-119(187)97(59-75-63-149-85-27-17-15-25-81(75)85)161-123(191)101(165-117(185)95(53-67(5)6)159-121(189)99(61-103(133)173)163-125(193)105(69(9)13-3)167-109(177)83(131)55-71-33-41-77(169)42-34-71)65-195-196-66-102(166-118(186)96(54-68(7)8)160-122(190)100(62-104(134)174)164-126(194)106(70(10)14-4)168-110(178)84(132)56-72-35-43-78(170)44-36-72)124(192)162-98(60-76-64-150-86-28-18-16-26-82(76)86)120(188)156-90(30-20-50-146-128(139)140)114(182)152-88(24-12-2)112(180)154-92(32-22-52-148-130(143)144)116(184)158-94(108(136)176)58-74-39-47-80(172)48-40-74/h15-18,25-28,33-48,63-64,67-70,83-84,87-102,105-106,149-150,169-172H,11-14,19-24,29-32,49-62,65-66,131-132H2,1-10H3,(H2,133,173)(H2,134,174)(H2,135,175)(H2,136,176)(H,151,181)(H,152,182)(H,153,179)(H,154,180)(H,155,187)(H,156,188)(H,157,183)(H,158,184)(H,159,189)(H,160,190)(H,161,191)(H,162,192)(H,163,193)(H,164,194)(H,165,185)(H,166,186)(H,167,177)(H,168,178)(H4,137,138,145)(H4,139,140,146)(H4,141,142,147)(H4,143,144,148)/t69-,70-,83-,84-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,105-,106-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
3.41E+3n/an/an/an/an/an/an/an/a



University of Cincinnati Medical Center

Curated by ChEMBL


Assay Description
Compound was tested for the displacement of [125I]-PYY(3-36) (SK-N-BE2) from Neuropeptide Y receptor type 2 in the membranes prepared from cells


J Med Chem 39: 811-3 (1996)


Article DOI: 10.1021/jm950811r
BindingDB Entry DOI: 10.7270/Q2FB5218
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 2


(Homo sapiens (Human))
BDBM50049741
PNG
(CHEMBL429071 | NPY-analogs)
Show SMILES CCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](NC(=O)[C@H](CSSC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O
Show InChI InChI=1S/C108H174N32O24S2/c1-13-21-71(91(151)127-73(23-17-43-121-105(113)114)95(155)131-77(87(111)147)51-63-31-39-67(145)40-32-63)125-93(153)75(25-19-45-123-107(117)118)129-103(163)85(59(11)141)139-99(159)81(135-97(157)79(47-55(5)6)133-101(161)83(57(9)15-3)137-89(149)69(109)49-61-27-35-65(143)36-28-61)53-165-166-54-82(136-98(158)80(48-56(7)8)134-102(162)84(58(10)16-4)138-90(150)70(110)50-62-29-37-66(144)38-30-62)100(160)140-86(60(12)142)104(164)130-76(26-20-46-124-108(119)120)94(154)126-72(22-14-2)92(152)128-74(24-18-44-122-106(115)116)96(156)132-78(88(112)148)52-64-33-41-68(146)42-34-64/h27-42,55-60,69-86,141-146H,13-26,43-54,109-110H2,1-12H3,(H2,111,147)(H2,112,148)(H,125,153)(H,126,154)(H,127,151)(H,128,152)(H,129,163)(H,130,164)(H,131,155)(H,132,156)(H,133,161)(H,134,162)(H,135,157)(H,136,158)(H,137,149)(H,138,150)(H,139,159)(H,140,160)(H4,113,114,121)(H4,115,116,122)(H4,117,118,123)(H4,119,120,124)/t57-,58-,59+,60+,69-,70-,71-,72-,73-,74-,75-,76-,77-,78-,79-,80-,81-,82-,83-,84-,85-,86-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
3.98E+3n/an/an/an/an/an/an/an/a



University of Cincinnati Medical Center

Curated by ChEMBL


Assay Description
Compound was tested for the displacement of [125I]-PYY(3-36) (SK-N-BE2) from Neuropeptide Y receptor type 2 in the membranes prepared from cells


J Med Chem 39: 811-3 (1996)


Article DOI: 10.1021/jm950811r
BindingDB Entry DOI: 10.7270/Q2FB5218
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 2


(Homo sapiens (Human))
BDBM50049744
PNG
(CHEMBL438548 | NPY-analogs | [Cys-Trp-Arg-Nva-Arg-...)
Show SMILES CCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CSSC[C@H](N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O
Show InChI InChI=1S/C80H118N28O14S2/c1-3-13-55(69(115)101-59(21-11-33-95-79(89)90)73(119)105-61(65(83)111)35-43-23-27-47(109)28-24-43)99-71(117)57(19-9-31-93-77(85)86)103-75(121)63(37-45-39-97-53-17-7-5-15-49(45)53)107-67(113)51(81)41-123-124-42-52(82)68(114)108-64(38-46-40-98-54-18-8-6-16-50(46)54)76(122)104-58(20-10-32-94-78(87)88)72(118)100-56(14-4-2)70(116)102-60(22-12-34-96-80(91)92)74(120)106-62(66(84)112)36-44-25-29-48(110)30-26-44/h5-8,15-18,23-30,39-40,51-52,55-64,97-98,109-110H,3-4,9-14,19-22,31-38,41-42,81-82H2,1-2H3,(H2,83,111)(H2,84,112)(H,99,117)(H,100,118)(H,101,115)(H,102,116)(H,103,121)(H,104,122)(H,105,119)(H,106,120)(H,107,113)(H,108,114)(H4,85,86,93)(H4,87,88,94)(H4,89,90,95)(H4,91,92,96)/t51-,52-,55-,56-,57-,58-,59-,60-,61-,62-,63-,64-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



University of Cincinnati Medical Center

Curated by ChEMBL


Assay Description
Compound was tested for the displacement of [125I]-PYY(3-36) (SK-N-BE2) from Neuropeptide Y receptor type 2 in the membranes prepared from cells


J Med Chem 39: 811-3 (1996)


Article DOI: 10.1021/jm950811r
BindingDB Entry DOI: 10.7270/Q2FB5218
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%