BDBM50245484 3-amino-N-((R)-3-(2,4-dichlorophenyl)-1-(4-(2-(1-hydroxy-3-methylbutyl)phenyl)piperazin-1-yl)-1-oxopropan-2-yl)propanamide::CHEMBL513404

SMILES: CC(C)CC(O)c1ccccc1N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)CCN

InChI Key: InChIKey=IKTNZHMAWQNOLP-XQZUBTRRSA-N

Data: 3 KI  1 IC50

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 4 hits for monomerid = 50245484   

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))	BDBM50245484 (3-amino-N-((R)-3-(2,4-dichlorophenyl)-1-(4-(2-(1-h...) Show SMILES CC(C)CC(O)c1ccccc1N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)CCN |r| Show InChI InChI=1S/C27H36Cl2N4O3/c1-18(2)15-25(34)21-5-3-4-6-24(21)32-11-13-33(14-12-32)27(36)23(31-26(35)9-10-30)16-19-7-8-20(28)17-22(19)29/h3-8,17-18,23,25,34H,9-16,30H2,1-2H3,(H,31,35)/t23-,25?/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences, Inc. Curated by ChEMBL					Assay Description Binding affinity to human MC4 receptor				Bioorg Med Chem Lett 18: 4817-22 (2008) Article DOI: 10.1016/j.bmcl.2008.07.076 BindingDB Entry DOI: 10.7270/Q24T6J75
					More data for this Ligand-Target Pair
Melanocortin receptor 5 (MC5R) (Homo sapiens (Human))	BDBM50245484 (3-amino-N-((R)-3-(2,4-dichlorophenyl)-1-(4-(2-(1-h...) Show SMILES CC(C)CC(O)c1ccccc1N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)CCN |r| Show InChI InChI=1S/C27H36Cl2N4O3/c1-18(2)15-25(34)21-5-3-4-6-24(21)32-11-13-33(14-12-32)27(36)23(31-26(35)9-10-30)16-19-7-8-20(28)17-22(19)29/h3-8,17-18,23,25,34H,9-16,30H2,1-2H3,(H,31,35)/t23-,25?/m1/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	970	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences, Inc. Curated by ChEMBL					Assay Description Binding affinity to MC5 receptor				Bioorg Med Chem Lett 18: 4817-22 (2008) Article DOI: 10.1016/j.bmcl.2008.07.076 BindingDB Entry DOI: 10.7270/Q24T6J75
					More data for this Ligand-Target Pair
Melanocortin receptor 3 (Homo sapiens (Human))	BDBM50245484 (3-amino-N-((R)-3-(2,4-dichlorophenyl)-1-(4-(2-(1-h...) Show SMILES CC(C)CC(O)c1ccccc1N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)CCN |r| Show InChI InChI=1S/C27H36Cl2N4O3/c1-18(2)15-25(34)21-5-3-4-6-24(21)32-11-13-33(14-12-32)27(36)23(31-26(35)9-10-30)16-19-7-8-20(28)17-22(19)29/h3-8,17-18,23,25,34H,9-16,30H2,1-2H3,(H,31,35)/t23-,25?/m1/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences, Inc. Curated by ChEMBL					Assay Description Binding affinity to MC3 receptor				Bioorg Med Chem Lett 18: 4817-22 (2008) Article DOI: 10.1016/j.bmcl.2008.07.076 BindingDB Entry DOI: 10.7270/Q24T6J75
					More data for this Ligand-Target Pair
Melanocortin receptor 4 (Homo sapiens (Human))	BDBM50245484 (3-amino-N-((R)-3-(2,4-dichlorophenyl)-1-(4-(2-(1-h...) Show SMILES CC(C)CC(O)c1ccccc1N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)CCN |r| Show InChI InChI=1S/C27H36Cl2N4O3/c1-18(2)15-25(34)21-5-3-4-6-24(21)32-11-13-33(14-12-32)27(36)23(31-26(35)9-10-30)16-19-7-8-20(28)17-22(19)29/h3-8,17-18,23,25,34H,9-16,30H2,1-2H3,(H,31,35)/t23-,25?/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences, Inc. Curated by ChEMBL					Assay Description Antagonist activity at human MC4 receptor expressed in cells assessed as inhibition of alpha-MSH-stimulated cAMP production				Bioorg Med Chem Lett 18: 4817-22 (2008) Article DOI: 10.1016/j.bmcl.2008.07.076 BindingDB Entry DOI: 10.7270/Q24T6J75
					More data for this Ligand-Target Pair