Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'C-C chemokine receptor type 5' and Ligand = 'BDBM50321724'   

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 5 (Homo sapiens (Human))	BDBM50321724 (CHEMBL1170923 | endo-4-Fluoro-N-((S)-3-(3-(2-methy...) Show SMILES Cc1nc2cccnc2n1C1C[C@H]2CC[C@H](C1)N2CC[C@H](NC(=O)c1ccc(F)cc1)c1cccc2ccccc12 |r,TLB:18:17:10.11.16:13.14,THB:9:10:17:13.14| Show InChI InChI=1S/C34H34FN5O/c1-22-37-32-10-5-18-36-33(32)40(22)28-20-26-15-16-27(21-28)39(26)19-17-31(38-34(41)24-11-13-25(35)14-12-24)30-9-4-7-23-6-2-3-8-29(23)30/h2-14,18,26-28,31H,15-17,19-21H2,1H3,(H,38,41)/t26-,27-,31+/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Materia Medica Curated by ChEMBL					Assay Description Antagonist activity at CCR5 expressed in CHO cells assessed as inhibition of RANTES-stimulated GTPgammaS binding by scintillation proximity assay				Eur J Med Chem 45: 2827-40 (2010) Article DOI: 10.1016/j.ejmech.2010.03.003 BindingDB Entry DOI: 10.7270/Q2FB5341
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