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BDBM50270314 3-[1'-{4'-(Isopropoxycarbonyl)-phenyl}]-quinuclidine-2-ene::CHEMBL479189

SMILES: CC(C)OC(=O)c1ccc(cc1)C1=CN2CCC1CC2

InChI Key: InChIKey=CZOPPYRFYUBYDM-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50270314   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Farnesyltransferase, putative


(Leishmania major)		BDBM50270314
PNG
(3-[1'-{4'-(Isopropoxycarbonyl)-phenyl}]-quinuclidi...)
Show SMILES CC(C)OC(=O)c1ccc(cc1)C1=CN2CCC1CC2 |t:13,(16.96,2.91,;15.62,3.68,;15.62,5.22,;14.29,2.91,;12.96,3.68,;12.96,5.22,;11.63,2.91,;11.62,1.37,;10.29,.6,;8.96,1.38,;8.96,2.91,;10.28,3.68,;7.63,.61,;7.63,-.94,;6.28,-1.71,;4.95,-.94,;4.95,.61,;6.28,1.39,;5.55,.03,;7.04,-.38,)|
Show InChI InChI=1S/C17H21NO2/c1-12(2)20-17(19)15-5-3-13(4-6-15)16-11-18-9-7-14(16)8-10-18/h3-6,11-12,14H,7-10H2,1-2H3
KEGG

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a>1.00E+3n/an/an/an/an/an/a



Cardiff University

Curated by ChEMBL


Assay Description
Inhibition of Leishmania major recombinant squalene synthase expressed in Escherichia coli by liquid scintillation counter

Antimicrob Agents Chemother 51: 4049-61 (2007)


Article DOI: 10.1128/AAC.00205-07
BindingDB Entry DOI: 10.7270/Q2MS3SJZ
More data for this
Ligand-Target Pair