Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'C-C chemokine receptor type 2' and Ligand = 'BDBM50255734'   

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))	BDBM50255734 ((+/-)-2-amino-N-(2-(2-(4-(methylthio)benzamido)cyc...) Show SMILES CSc1ccc(cc1)C(=O)NC1CCCCC1NC(=O)CNC(=O)c1cc(ccc1N)C(F)(F)F Show InChI InChI=1S/C24H27F3N4O3S/c1-35-16-9-6-14(7-10-16)22(33)31-20-5-3-2-4-19(20)30-21(32)13-29-23(34)17-12-15(24(25,26)27)8-11-18(17)28/h6-12,19-20H,2-5,13,28H2,1H3,(H,29,34)(H,30,32)(H,31,33)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	155	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Displacement of [125I]MCP1 from CCR2 in human PBMCs				Bioorg Med Chem Lett 19: 597-601 (2009) Article DOI: 10.1016/j.bmcl.2008.12.062 BindingDB Entry DOI: 10.7270/Q2QF8SR1
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