Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'C-C chemokine receptor type 3' and Ligand = 'BDBM50162372'   

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 3 (Homo sapiens (Human))	BDBM50162372 (1-[2-(4-Cyclohexyl-piperazin-1-yl)-4-methyl-pentyl...) Show SMILES CC(C)CC(CNC(=O)Nc1cc(Cl)cc(Cl)c1)N1CCN(CC1)C1CCCCC1 Show InChI InChI=1S/C23H36Cl2N4O/c1-17(2)12-22(16-26-23(30)27-20-14-18(24)13-19(25)15-20)29-10-8-28(9-11-29)21-6-4-3-5-7-21/h13-15,17,21-22H,3-12,16H2,1-2H3,(H2,26,27,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	296	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Biographics Laboratory 3R Curated by ChEMBL					Assay Description Inhibition of [125I]-eotaxin-1 binding to human chemokine receptor (hCCR3-C1)				J Med Chem 48: 1515-27 (2005) Article DOI: 10.1021/jm040827u BindingDB Entry DOI: 10.7270/Q2KK9B8W
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