BDBM50121827 (R)-Cyclohexyl-[(3S,4S)-3-{4-[2-(4-fluoro-benzenesulfonyl)-ethyl]-piperidin-1-ylmethyl}-4-(3-fluoro-phenyl)-pyrrolidin-1-yl]-acetic acid::CHEMBL280344

SMILES: OC(=O)[C@@H](C1CCCCC1)N1C[C@H](CN2CCC(CCS(=O)(=O)c3ccc(F)cc3)CC2)[C@H](C1)c1cccc(F)c1

InChI Key: InChIKey=HNGKQKBNYUXDJL-MAJWKWKESA-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 = 50121827   

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))	BDBM50121827 ((R)-Cyclohexyl-[(3S,4S)-3-{4-[2-(4-fluoro-benzenes...) Show SMILES OC(=O)[C@@H](C1CCCCC1)N1C[C@H](CN2CCC(CCS(=O)(=O)c3ccc(F)cc3)CC2)[C@H](C1)c1cccc(F)c1 Show InChI InChI=1S/C32H42F2N2O4S/c33-27-9-11-29(12-10-27)41(39,40)18-15-23-13-16-35(17-14-23)20-26-21-36(22-30(26)25-7-4-8-28(34)19-25)31(32(37)38)24-5-2-1-3-6-24/h4,7-12,19,23-24,26,30-31H,1-3,5-6,13-18,20-22H2,(H,37,38)/t26-,30+,31+/m0/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	1.10	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Ability to displace [125I]- labeled MIP-1alpha from CCR5 receptor expressed on CHO cell membrane				Bioorg Med Chem Lett 13: 119-23 (2002) BindingDB Entry DOI: 10.7270/Q2CN7382
					More data for this Ligand-Target Pair