Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'C-C motif chemokine 5' and Ligand = 'BDBM50329232'   

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 motif chemokine 5 (Homo sapiens (Human))	BDBM50329232 (((3aR,6aS)-5-(3-(1-(2,2-difluoroethyl)piperidin-4-...) Show SMILES Cc1ncnc(C)c1C(=O)N1C[C@@H]2CN(CCC(C3CCN(CC(F)F)CC3)c3cc(F)cc(F)c3)C[C@@H]2C1 |r| Show InChI InChI=1S/C29H37F4N5O/c1-18-28(19(2)35-17-34-18)29(39)38-14-22-12-37(13-23(22)15-38)8-5-26(21-9-24(30)11-25(31)10-21)20-3-6-36(7-4-20)16-27(32)33/h9-11,17,20,22-23,26-27H,3-8,12-16H2,1-2H3/t22-,23+,26?	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
Roche Palo Alto Curated by ChEMBL					Assay Description Inhibition of RANTES				Bioorg Med Chem Lett 20: 6802-7 (2010) Article DOI: 10.1016/j.bmcl.2010.08.118 BindingDB Entry DOI: 10.7270/Q29G5N1F
					More data for this Ligand-Target Pair