Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'C-C chemokine receptor type 5' and Ligand = 'BDBM50321720'   

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))	BDBM50321720 (CHEMBL1170738 | N-((S)-3-(4-benzyl-4-(hydroxymethy...) Show SMILES OCC1(Cc2ccccc2)CCN(CC[C@H](NC(=O)C2CCC2)c2ccc(cc2)C(F)(F)F)CC1 |r| Show InChI InChI=1S/C28H35F3N2O2/c29-28(30,31)24-11-9-22(10-12-24)25(32-26(35)23-7-4-8-23)13-16-33-17-14-27(20-34,15-18-33)19-21-5-2-1-3-6-21/h1-3,5-6,9-12,23,25,34H,4,7-8,13-20H2,(H,32,35)/t25-/m0/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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