BDBM50032199 (S)-3-[(S)-2-((S)-2-Acetylamino-3,3-diphenyl-propionylamino)-4-methyl-pentanoylamino]-N-((S)-5-amino-1-{(1S,2S)-1-[(S)-1-carboxy-2-(1H-indol-3-yl)-ethylcarbamoyl]-2-methyl-butylcarbamoyl}-pentyl)-succinamic acid::CHEMBL94525

SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O

InChI Key InChIKey=ALWPEEGNMHILML-VVKSDJSFSA-N

Data  3 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50032199   

TargetEndothelin-1 receptor(Homo sapiens (Human))
Warner-Lambert Company

Curated by ChEMBL
LigandPNGBDBM50032199((S)-3-[(S)-2-((S)-2-Acetylamino-3,3-diphenyl-propi...)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1S/C50H66N8O10/c1-6-30(4)43(48(65)57-40(50(67)68)26-34-28-52-36-22-14-13-21-35(34)36)58-45(62)37(23-15-16-24-51)54-47(64)39(27-41(60)61)55-46(63)38(25-29(2)3)56-49(66)44(53-31(5)59)42(32-17-9-7-10-18-32)33-19-11-8-12-20-33/h7-14,17-22,28-30,37-40,42-44,52H,6,15-16,23-27,51H2,1-5H3,(H,53,59)(H,54,64)(H,55,63)(H,56,66)(H,57,65)(H,58,62)(H,60,61)(H,67,68)/t30-,37-,38-,39-,40-,43-,44-/m0/s1
Affinity DataIC50: 1.00E+4nMAssay Description:Binding affinity against endothelin A receptor from rabbit renal vascular smooth musclesMore data for this Ligand-Target Pair
TargetEndothelin-1 receptor(Homo sapiens (Human))
Warner-Lambert Company

Curated by ChEMBL
LigandPNGBDBM50032199((S)-3-[(S)-2-((S)-2-Acetylamino-3,3-diphenyl-propi...)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1S/C50H66N8O10/c1-6-30(4)43(48(65)57-40(50(67)68)26-34-28-52-36-22-14-13-21-35(34)36)58-45(62)37(23-15-16-24-51)54-47(64)39(27-41(60)61)55-46(63)38(25-29(2)3)56-49(66)44(53-31(5)59)42(32-17-9-7-10-18-32)33-19-11-8-12-20-33/h7-14,17-22,28-30,37-40,42-44,52H,6,15-16,23-27,51H2,1-5H3,(H,53,59)(H,54,64)(H,55,63)(H,56,66)(H,57,65)(H,58,62)(H,60,61)(H,67,68)/t30-,37-,38-,39-,40-,43-,44-/m0/s1
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of ET-1 stimulated arachidonic acid release in rabbit renal vascular smooth muscle cellsMore data for this Ligand-Target Pair