Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 506.6 BDBM50257489

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))	BDBM50257489 (2-methyl-1-(8-(2-(4-phenyl-1-(pyrimidin-2-yl)piper...) Show SMILES Cc1nc2ccccc2n1[C@@H]1C[C@@H]2CC[C@H](C1)N2CCC1(CCN(CC1)c1ncccn1)c1ccccc1 |r,TLB:9:10:17:13.14| Show InChI InChI=1S/C32H38N6/c1-24-35-29-10-5-6-11-30(29)38(24)28-22-26-12-13-27(23-28)37(26)21-16-32(25-8-3-2-4-9-25)14-19-36(20-15-32)31-33-17-7-18-34-31/h2-11,17-18,26-28H,12-16,19-23H2,1H3/t26-,27+,28+	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	320	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Displacement of [125I]MIP-1beta from CCR5 (unknown origin) expressed in CHO cell membrane				Bioorg Med Chem Lett 19: 1610-3 (2009) Article DOI: 10.1016/j.bmcl.2009.02.014 BindingDB Entry DOI: 10.7270/Q2VQ32JR
					More data for this Ligand-Target Pair