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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 335.5
BDBM50051382

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)
BDBM50051382
PNG
((6S,8aS)-2-Dodecyl-8a-methyl-1,2,3,5,6,7,8,8a-octa...)
Show SMILES CCCCCCCCCCCCN1CC=C2C[C@@H](O)CC[C@]2(C)C1 |t:14|
Show InChI InChI=1S/C22H41NO/c1-3-4-5-6-7-8-9-10-11-12-16-23-17-14-20-18-21(24)13-15-22(20,2)19-23/h14,21,24H,3-13,15-19H2,1-2H3/t21-,22+/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.64E+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