BDBM50152288 CHEMBL187167::N-[(S)-1-((S)-1-{(S)-1-[(S)-1-Carbamoyl-2-(1H-indol-3-yl)-ethylcarbamoyl]-4-guanidino-butylcarbamoyl}-2-phenyl-ethylcarbamoyl)-2-(4-chloro-phenyl)-ethyl]-malonamide

SMILES: NC(=N)NCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O

InChI Key: InChIKey=UALYLLNCUOTCCI-ORYMTKCHSA-N

Data: 3 EC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50152288   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Melanocortin receptor 3 (Homo sapiens (Human))	BDBM50152288 (CHEMBL187167 | N-[(S)-1-((S)-1-{(S)-1-[(S)-1-Carba...) Show SMILES NC(=N)NCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O Show InChI InChI=1S/C38H45ClN10O6/c39-25-14-12-23(13-15-25)18-30(46-33(51)20-32(40)50)36(54)49-31(17-22-7-2-1-3-8-22)37(55)47-28(11-6-16-44-38(42)43)35(53)48-29(34(41)52)19-24-21-45-27-10-5-4-9-26(24)27/h1-5,7-10,12-15,21,28-31,45H,6,11,16-20H2,(H2,40,50)(H2,41,52)(H,46,51)(H,47,55)(H,48,53)(H,49,54)(H4,42,43,44)/t28-,29-,30-,31-/m0/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.01E+3	n/a	n/a	n/a	n/a
University of Cincinnati Curated by ChEMBL					Assay Description Agonistic activity against against human Melanocortin 3 receptor				Bioorg Med Chem Lett 14: 4839-42 (2004) Article DOI: 10.1016/j.bmcl.2004.07.046 BindingDB Entry DOI: 10.7270/Q2445KX8
					More data for this Ligand-Target Pair
Melanocortin receptor 4 (Homo sapiens (Human))	BDBM50152288 (CHEMBL187167 | N-[(S)-1-((S)-1-{(S)-1-[(S)-1-Carba...) Show SMILES NC(=N)NCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O Show InChI InChI=1S/C38H45ClN10O6/c39-25-14-12-23(13-15-25)18-30(46-33(51)20-32(40)50)36(54)49-31(17-22-7-2-1-3-8-22)37(55)47-28(11-6-16-44-38(42)43)35(53)48-29(34(41)52)19-24-21-45-27-10-5-4-9-26(24)27/h1-5,7-10,12-15,21,28-31,45H,6,11,16-20H2,(H2,40,50)(H2,41,52)(H,46,51)(H,47,55)(H,48,53)(H,49,54)(H4,42,43,44)/t28-,29-,30-,31-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	15	n/a	n/a	n/a	n/a
University of Cincinnati Curated by ChEMBL					Assay Description Agonistic activity against against human Melanocortin 4 receptor				Bioorg Med Chem Lett 14: 4839-42 (2004) Article DOI: 10.1016/j.bmcl.2004.07.046 BindingDB Entry DOI: 10.7270/Q2445KX8
					More data for this Ligand-Target Pair
Melanocyte-stimulating hormone receptor (Homo sapiens (Human))	BDBM50152288 (CHEMBL187167 | N-[(S)-1-((S)-1-{(S)-1-[(S)-1-Carba...) Show SMILES NC(=N)NCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O Show InChI InChI=1S/C38H45ClN10O6/c39-25-14-12-23(13-15-25)18-30(46-33(51)20-32(40)50)36(54)49-31(17-22-7-2-1-3-8-22)37(55)47-28(11-6-16-44-38(42)43)35(53)48-29(34(41)52)19-24-21-45-27-10-5-4-9-26(24)27/h1-5,7-10,12-15,21,28-31,45H,6,11,16-20H2,(H2,40,50)(H2,41,52)(H,46,51)(H,47,55)(H,48,53)(H,49,54)(H4,42,43,44)/t28-,29-,30-,31-/m0/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	597	n/a	n/a	n/a	n/a
University of Cincinnati Curated by ChEMBL					Assay Description Agonistic activity against against human Melanocortin 1 receptor				Bioorg Med Chem Lett 14: 4839-42 (2004) Article DOI: 10.1016/j.bmcl.2004.07.046 BindingDB Entry DOI: 10.7270/Q2445KX8
					More data for this Ligand-Target Pair