BDBM50096573 CHEMBL88219::N-[2-(4-Fluoro-3-methyl-phenyl)-4-(4-phenyl-piperidin-1-yl)-butyl]-N-methyl-benzenesulfonamide

SMILES: CN(CC(CCN1CCC(CC1)c1ccccc1)c1ccc(F)c(C)c1)S(=O)(=O)c1ccccc1

InChI Key: InChIKey=BEWKHHCHGVKALU-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50096573   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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))	BDBM50096573 (CHEMBL88219 | N-[2-(4-Fluoro-3-methyl-phenyl)-4-(4...) Show SMILES CN(CC(CCN1CCC(CC1)c1ccccc1)c1ccc(F)c(C)c1)S(=O)(=O)c1ccccc1 Show InChI InChI=1S/C29H35FN2O2S/c1-23-21-26(13-14-29(23)30)27(22-31(2)35(33,34)28-11-7-4-8-12-28)17-20-32-18-15-25(16-19-32)24-9-5-3-6-10-24/h3-14,21,25,27H,15-20,22H2,1-2H3	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibitory activity against specific binding of [125I]-MIP-1 alpha to human CCR5 receptor.				Bioorg Med Chem Lett 11: 265-70 (2001) BindingDB Entry DOI: 10.7270/Q2668CFZ
					More data for this Ligand-Target Pair