BDBM50245368 (2R)-1-(4-(2-(1-amino-3-methylbutyl)phenyl)piperazin-1-yl)-3-(2,4-dichlorophenyl)-2-((tetrahydrofuran-3-yl)methylamino)propan-1-one::CHEMBL462346

SMILES: CC(C)CC(N)c1ccccc1N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1Cl)NCC1CCOC1

InChI Key: InChIKey=NWGKXGYKMBHTML-ZSPKOWADSA-N

Data: 1 KI

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 1 hit for monomerid = 50245368   

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))	BDBM50245368 ((2R)-1-(4-(2-(1-amino-3-methylbutyl)phenyl)piperaz...) Show SMILES CC(C)CC(N)c1ccccc1N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1Cl)NCC1CCOC1 |r| Show InChI InChI=1S/C29H40Cl2N4O2/c1-20(2)15-26(32)24-5-3-4-6-28(24)34-10-12-35(13-11-34)29(36)27(33-18-21-9-14-37-19-21)16-22-7-8-23(30)17-25(22)31/h3-8,17,20-21,26-27,33H,9-16,18-19,32H2,1-2H3/t21?,26?,27-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	15	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