BDBM50214058 (1S,3S)-N1-(7-methoxy-4-methylquinolin-2-yl)-N3-(pyrazin-2-ylmethyl)cyclohexane-1,3-diamine::CHEMBL250122

SMILES: COc1ccc2c(C)cc(N[C@H]3CCC[C@@H](C3)NCc3cnccn3)nc2c1

InChI Key: InChIKey=VRHBYCXPGQMIJD-IRXDYDNUSA-N

Data: 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 1 hit for monomerid = 50214058   

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
Melanin-concentrating hormone receptor (Homo sapiens (Human))	BDBM50214058 ((1S,3S)-N1-(7-methoxy-4-methylquinolin-2-yl)-N3-(p...) Show SMILES COc1ccc2c(C)cc(N[C@H]3CCC[C@@H](C3)NCc3cnccn3)nc2c1 Show InChI InChI=1S/C22H27N5O/c1-15-10-22(27-21-12-19(28-2)6-7-20(15)21)26-17-5-3-4-16(11-17)25-14-18-13-23-8-9-24-18/h6-10,12-13,16-17,25H,3-5,11,14H2,1-2H3,(H,26,27)/t16-,17-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	89	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca R&D Mölndal Curated by ChEMBL					Assay Description Displacement of [125I]MCH from human MCHR1 expressed in HEK293 cells				Bioorg Med Chem Lett 17: 4232-41 (2007) Article DOI: 10.1016/j.bmcl.2007.05.034 BindingDB Entry DOI: 10.7270/Q27W6BVC
					More data for this Ligand-Target Pair