BDBM50253742 1-Amino-N-((1R)-1-[(4-fluorophenyl)methyl]-2-{(2S)-4-[(1S)-2-(methylamino)-1-(2-naphthalenylmethyl)-2-oxoethyl]-3-oxo-2-propyl-1-piperazinyl}-2-oxoethyl)cyclopropanecarboxamide::CHEMBL451694

SMILES: CCC[C@@H]1N(CCN([C@@H](Cc2ccc3ccccc3c2)C(=O)NC)C1=O)C(=O)[C@@H](Cc1ccc(F)cc1)NC(=O)C1(N)CC1

InChI Key: InChIKey=GEDCOLLODBJRNS-ULNSLHSMSA-N

Data: 3 KI  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 6 hits for monomerid = 50253742   

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 4 (Homo sapiens (Human))	BDBM50253742 (1-Amino-N-((1R)-1-[(4-fluorophenyl)methyl]-2-{(2S)...) Show SMILES CCC[C@@H]1N(CCN([C@@H](Cc2ccc3ccccc3c2)C(=O)NC)C1=O)C(=O)[C@@H](Cc1ccc(F)cc1)NC(=O)C1(N)CC1 |r| Show InChI InChI=1S/C34H40FN5O4/c1-3-6-28-32(43)40(29(30(41)37-2)21-23-9-12-24-7-4-5-8-25(24)19-23)18-17-39(28)31(42)27(38-33(44)34(36)15-16-34)20-22-10-13-26(35)14-11-22/h4-5,7-14,19,27-29H,3,6,15-18,20-21,36H2,1-2H3,(H,37,41)(H,38,44)/t27-,28+,29+/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	26	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Procter & Gamble Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of europium-labeled NDP-alpha-MSH from human MC4R expressed in HEK293 cells				J Med Chem 51: 6055-66 (2008) Article DOI: 10.1021/jm800525p BindingDB Entry DOI: 10.7270/Q2DV1JQC
					More data for this Ligand-Target Pair
Melanocortin receptor 3 (Homo sapiens (Human))	BDBM50253742 (1-Amino-N-((1R)-1-[(4-fluorophenyl)methyl]-2-{(2S)...) Show SMILES CCC[C@@H]1N(CCN([C@@H](Cc2ccc3ccccc3c2)C(=O)NC)C1=O)C(=O)[C@@H](Cc1ccc(F)cc1)NC(=O)C1(N)CC1 |r| Show InChI InChI=1S/C34H40FN5O4/c1-3-6-28-32(43)40(29(30(41)37-2)21-23-9-12-24-7-4-5-8-25(24)19-23)18-17-39(28)31(42)27(38-33(44)34(36)15-16-34)20-22-10-13-26(35)14-11-22/h4-5,7-14,19,27-29H,3,6,15-18,20-21,36H2,1-2H3,(H,37,41)(H,38,44)/t27-,28+,29+/m1/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	434	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Procter & Gamble Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of europium-labeled NDP-alpha-MSH from human MC3R expressed in HEK293 cells				J Med Chem 51: 6055-66 (2008) Article DOI: 10.1021/jm800525p BindingDB Entry DOI: 10.7270/Q2DV1JQC
					More data for this Ligand-Target Pair
Melanocyte-stimulating hormone receptor (Homo sapiens (Human))	BDBM50253742 (1-Amino-N-((1R)-1-[(4-fluorophenyl)methyl]-2-{(2S)...) Show SMILES CCC[C@@H]1N(CCN([C@@H](Cc2ccc3ccccc3c2)C(=O)NC)C1=O)C(=O)[C@@H](Cc1ccc(F)cc1)NC(=O)C1(N)CC1 |r| Show InChI InChI=1S/C34H40FN5O4/c1-3-6-28-32(43)40(29(30(41)37-2)21-23-9-12-24-7-4-5-8-25(24)19-23)18-17-39(28)31(42)27(38-33(44)34(36)15-16-34)20-22-10-13-26(35)14-11-22/h4-5,7-14,19,27-29H,3,6,15-18,20-21,36H2,1-2H3,(H,37,41)(H,38,44)/t27-,28+,29+/m1/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.66E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Procter & Gamble Pharmaceuticals Curated by ChEMBL					Assay Description Agonist activity at human MC1R expressed in HEK293 cells assessed as effect on CRE-driven luminescence by luciferase reporter gene assay				J Med Chem 51: 6055-66 (2008) Article DOI: 10.1021/jm800525p BindingDB Entry DOI: 10.7270/Q2DV1JQC
					More data for this Ligand-Target Pair
Melanocortin receptor 4 (Homo sapiens (Human))	BDBM50253742 (1-Amino-N-((1R)-1-[(4-fluorophenyl)methyl]-2-{(2S)...) Show SMILES CCC[C@@H]1N(CCN([C@@H](Cc2ccc3ccccc3c2)C(=O)NC)C1=O)C(=O)[C@@H](Cc1ccc(F)cc1)NC(=O)C1(N)CC1 |r| Show InChI InChI=1S/C34H40FN5O4/c1-3-6-28-32(43)40(29(30(41)37-2)21-23-9-12-24-7-4-5-8-25(24)19-23)18-17-39(28)31(42)27(38-33(44)34(36)15-16-34)20-22-10-13-26(35)14-11-22/h4-5,7-14,19,27-29H,3,6,15-18,20-21,36H2,1-2H3,(H,37,41)(H,38,44)/t27-,28+,29+/m1/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	47	n/a	n/a	n/a	n/a
Procter & Gamble Pharmaceuticals Curated by ChEMBL					Assay Description Agonist activity at human MC4R expressed in HEK293 cells assessed as effect on CRE-driven luminescence by luciferase reporter gene assay				J Med Chem 51: 6055-66 (2008) Article DOI: 10.1021/jm800525p BindingDB Entry DOI: 10.7270/Q2DV1JQC
					More data for this Ligand-Target Pair
Melanocyte-stimulating hormone receptor (Homo sapiens (Human))	BDBM50253742 (1-Amino-N-((1R)-1-[(4-fluorophenyl)methyl]-2-{(2S)...) Show SMILES CCC[C@@H]1N(CCN([C@@H](Cc2ccc3ccccc3c2)C(=O)NC)C1=O)C(=O)[C@@H](Cc1ccc(F)cc1)NC(=O)C1(N)CC1 |r| Show InChI InChI=1S/C34H40FN5O4/c1-3-6-28-32(43)40(29(30(41)37-2)21-23-9-12-24-7-4-5-8-25(24)19-23)18-17-39(28)31(42)27(38-33(44)34(36)15-16-34)20-22-10-13-26(35)14-11-22/h4-5,7-14,19,27-29H,3,6,15-18,20-21,36H2,1-2H3,(H,37,41)(H,38,44)/t27-,28+,29+/m1/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	734	n/a	n/a	n/a	n/a
Procter & Gamble Pharmaceuticals Curated by ChEMBL					Assay Description Agonist activity at human MC1R expressed in HEK293 cells assessed as effect on CRE-driven luminescence by luciferase reporter gene assay				J Med Chem 51: 6055-66 (2008) Article DOI: 10.1021/jm800525p BindingDB Entry DOI: 10.7270/Q2DV1JQC
					More data for this Ligand-Target Pair
Melanocortin receptor 3 (Homo sapiens (Human))	BDBM50253742 (1-Amino-N-((1R)-1-[(4-fluorophenyl)methyl]-2-{(2S)...) Show SMILES CCC[C@@H]1N(CCN([C@@H](Cc2ccc3ccccc3c2)C(=O)NC)C1=O)C(=O)[C@@H](Cc1ccc(F)cc1)NC(=O)C1(N)CC1 |r| Show InChI InChI=1S/C34H40FN5O4/c1-3-6-28-32(43)40(29(30(41)37-2)21-23-9-12-24-7-4-5-8-25(24)19-23)18-17-39(28)31(42)27(38-33(44)34(36)15-16-34)20-22-10-13-26(35)14-11-22/h4-5,7-14,19,27-29H,3,6,15-18,20-21,36H2,1-2H3,(H,37,41)(H,38,44)/t27-,28+,29+/m1/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	848	n/a	n/a	n/a	n/a
Procter & Gamble Pharmaceuticals Curated by ChEMBL					Assay Description Agonist activity at human MC3R expressed in HEK293 cells assessed as effect on CRE-driven luminescence by luciferase reporter gene assay				J Med Chem 51: 6055-66 (2008) Article DOI: 10.1021/jm800525p BindingDB Entry DOI: 10.7270/Q2DV1JQC
					More data for this Ligand-Target Pair