BDBM50052344 3-Biphenyl-3-yl-1-aza-bicyclo[2.2.2]octan-3-ol::CHEMBL327738

SMILES: OC1(CN2CCC1CC2)c1cccc(c1)-c1ccccc1

InChI Key: InChIKey=BBRATLQYMGFDRS-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 = 50052344   

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
Squalene synthetase (Rattus norvegicus)	BDBM50052344 (3-Biphenyl-3-yl-1-aza-bicyclo[2.2.2]octan-3-ol | C...) Show SMILES OC1(CN2CCC1CC2)c1cccc(c1)-c1ccccc1 |TLB:9:1:7.8:5.4,0:1:7.8:5.4,(12.8,-5.94,;12.68,-8.03,;12.94,-9.41,;11.58,-8.79,;11.84,-6.9,;11.33,-5.72,;11.33,-7.42,;9.86,-8.06,;10.05,-9.44,;14.22,-8.03,;14.98,-6.71,;16.5,-6.71,;17.29,-8.03,;16.52,-9.38,;14.98,-9.38,;17.29,-10.69,;18.81,-10.69,;19.58,-12.03,;18.81,-13.36,;17.27,-13.36,;16.5,-12.03,)| Show InChI InChI=1S/C19H21NO/c21-19(14-20-11-9-17(19)10-12-20)18-8-4-7-16(13-18)15-5-2-1-3-6-15/h1-8,13,17,21H,9-12,14H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
Zeneca Pharmaceuticals Curated by ChEMBL					Assay Description In vitro inhibition against rat microsomal squalene synthase (SS)				J Med Chem 39: 2971-9 (1996) Article DOI: 10.1021/jm950907l BindingDB Entry DOI: 10.7270/Q24J0D7G
					More data for this Ligand-Target Pair