Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'C-C chemokine receptor type 2' and Ligand = 'BDBM50359103'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
C-C chemokine receptor type 2 (Homo sapiens (Human))	BDBM50359103 (CHEMBL1922812) Show SMILES NC(=O)C(NC1CCC(CC1)c1c[nH]c2ccccc12)C1CCN(Cc2ccccc2)CC1 |(9.11,-9.98,;10.45,-10.75,;11.78,-9.99,;10.44,-12.29,;9.11,-13.06,;9.11,-14.6,;7.77,-15.36,;7.76,-16.89,;9.09,-17.67,;10.43,-16.9,;10.44,-15.36,;9.09,-19.21,;7.84,-20.12,;8.32,-21.58,;9.86,-21.57,;10.89,-22.71,;12.39,-22.39,;12.86,-20.92,;11.83,-19.79,;10.34,-20.11,;11.77,-13.07,;11.76,-14.61,;13.08,-15.38,;14.42,-14.62,;15.75,-15.4,;17.09,-14.64,;18.41,-15.43,;19.75,-14.67,;19.76,-13.12,;18.43,-12.35,;17.09,-13.11,;14.43,-13.08,;13.1,-12.3,)| Show InChI InChI=1S/C28H36N4O/c29-28(33)27(22-14-16-32(17-15-22)19-20-6-2-1-3-7-20)31-23-12-10-21(11-13-23)25-18-30-26-9-5-4-8-24(25)26/h1-9,18,21-23,27,30-31H,10-17,19H2,(H2,29,33)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Johnson& Johnson Pharmaceutical Research and Development Curated by ChEMBL					Assay Description Antagonist activity at human CCR2				Bioorg Med Chem Lett 21: 7496-501 (2011) Article DOI: 10.1016/j.bmcl.2011.09.113 BindingDB Entry DOI: 10.7270/Q22J6C9M
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