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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cycloartenol-C-24-methyltransferase' and Ligand = 'BDBM50195632'   
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
Cycloartenol-C-24-methyltransferase


(Arabidopsis thaliana)
BDBM50195632
PNG
(3beta-acetoxy-23,24-bisnor-5-en-22-(5-(2-Z-amino)p...)
Show SMILES C[C@H](CNCCC[C@H](NC(=O)OCc1ccccc1)C(O)=O)[C@H]1CC[C@H]2C3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(C)=O |t:29|
Show InChI InChI=1S/C37H54N2O6/c1-24(22-38-20-8-11-33(34(41)42)39-35(43)44-23-26-9-6-5-7-10-26)30-14-15-31-29-13-12-27-21-28(45-25(2)40)16-18-36(27,3)32(29)17-19-37(30,31)4/h5-7,9-10,12,24,28-33,38H,8,11,13-23H2,1-4H3,(H,39,43)(H,41,42)/t24-,28+,29?,30-,31+,32+,33+,36+,37-/m1/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Cardiff University

Curated by ChEMBL


Assay Description
Inhibition of Leishmania major recombinant 24-SMT


J Med Chem 49: 6094-103 (2006)


Article DOI: 10.1021/jm060290f
BindingDB Entry DOI: 10.7270/Q2TB16JJ
More data for this
Ligand-Target Pair