Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'C-C chemokine receptor type 5' and Ligand = 'BDBM50205733'   

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))	BDBM50205733 (CHEMBL219769 | N-(1-benzylpiperidin-4-yl)-2-(5-met...) Show SMILES Cc1nnc(SCC(=O)NC2CCN(Cc3ccccc3)CC2)n1-c1ccc(C)cc1 Show InChI InChI=1S/C24H29N5OS/c1-18-8-10-22(11-9-18)29-19(2)26-27-24(29)31-17-23(30)25-21-12-14-28(15-13-21)16-20-6-4-3-5-7-20/h3-11,21H,12-17H2,1-2H3,(H,25,30)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.69E+5	n/a	n/a	n/a	n/a	n/a	n/a
CNRS UMR 7175-LC1 Curated by ChEMBL					Assay Description Displacement of [125I]MIP1beta from CCR5 expressed in CHO-K1 cells				J Med Chem 50: 1294-303 (2007) Article DOI: 10.1021/jm061389p BindingDB Entry DOI: 10.7270/Q2KD1XK6
					More data for this Ligand-Target Pair
C-C chemokine receptor type 5 (Homo sapiens (Human))	BDBM50205733 (CHEMBL219769 | N-(1-benzylpiperidin-4-yl)-2-(5-met...) Show SMILES Cc1nnc(SCC(=O)NC2CCN(Cc3ccccc3)CC2)n1-c1ccc(C)cc1 Show InChI InChI=1S/C24H29N5OS/c1-18-8-10-22(11-9-18)29-19(2)26-27-24(29)31-17-23(30)25-21-12-14-28(15-13-21)16-20-6-4-3-5-7-20/h3-11,21H,12-17H2,1-2H3,(H,25,30)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.35E+4	n/a	n/a	n/a	n/a
CNRS UMR 7175-LC1 Curated by ChEMBL					Assay Description Agonist activity at CCR5 expressed in CHO-K1 cells in aqeuorin based assay				J Med Chem 50: 1294-303 (2007) Article DOI: 10.1021/jm061389p BindingDB Entry DOI: 10.7270/Q2KD1XK6
					More data for this Ligand-Target Pair