Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'C-C chemokine receptor type 3' and Ligand = 'BDBM50162421'   

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))	BDBM50162421 (1-[2-(4-tert-Butyl-phenyl)-2-(4-cyclohexyl-piperaz...) Show SMILES CC(C)(C)c1ccc(cc1)C(CNC(=O)Nc1ccccc1)N1CCN(CC1)C1CCCCC1 Show InChI InChI=1S/C29H42N4O/c1-29(2,3)24-16-14-23(15-17-24)27(22-30-28(34)31-25-10-6-4-7-11-25)33-20-18-32(19-21-33)26-12-8-5-9-13-26/h4,6-7,10-11,14-17,26-27H,5,8-9,12-13,18-22H2,1-3H3,(H2,30,31,34)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.13E+3	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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