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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 285.4
BDBM50051378

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Lanosterol synthase


(Rattus norvegicus)
BDBM50051378
PNG
((6S,8aS)-2-Benzyl-5,5,8a-trimethyl-1,2,3,5,6,7,8,8...)
Show SMILES CC1(C)[C@@H](O)CC[C@]2(C)CN(Cc3ccccc3)CC=C12 |t:20|
Show InChI InChI=1S/C19H27NO/c1-18(2)16-10-12-20(13-15-7-5-4-6-8-15)14-19(16,3)11-9-17(18)21/h4-8,10,17,21H,9,11-14H2,1-3H3/t17-,19+/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.50E+4n/an/an/an/an/an/a



Laboratoires Fournier SCA

Curated by ChEMBL


Assay Description
Inhibitory activity against Oxidosqualene-lanosterol cyclase from Rat liver microsomes


J Med Chem 39: 2302-12 (1996)


Article DOI: 10.1021/jm9504621
BindingDB Entry DOI: 10.7270/Q28G8JTB
More data for this
Ligand-Target Pair