Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 565.7 BDBM50205766

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

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))	BDBM50205766 (1-(2-(4-chlorobenzyloxy)-5-bromobenzyl)-4-(4-bromo...) Show SMILES OC1(CCN(Cc2cc(Br)ccc2OCc2ccc(Cl)cc2)CC1)c1ccc(Br)cc1 Show InChI InChI=1S/C25H24Br2ClNO2/c26-21-5-3-20(4-6-21)25(30)11-13-29(14-12-25)16-19-15-22(27)7-10-24(19)31-17-18-1-8-23(28)9-2-18/h1-10,15,30H,11-14,16-17H2	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Berlex Biosciences Curated by ChEMBL					Assay Description Displacement of [125I]MIP1alpha from human CCR5 receptor expressed in HEK293 cells coexpressing CD4				Bioorg Med Chem Lett 17: 1883-7 (2007) Article DOI: 10.1016/j.bmcl.2007.01.050 BindingDB Entry DOI: 10.7270/Q29Z94KR
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