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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 = 'BDBM50195653'   
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)		BDBM50195653
PNG
(3beta-ol-23,24-bisnor-5-en-22-(ethanoic acid) amid...)
Show SMILES C[C@@H]([C@H]1CC[C@H]2C3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(=O)NCC(O)=O |t:8|
Show InChI InChI=1S/C24H37NO4/c1-14(22(29)25-13-21(27)28)18-6-7-19-17-5-4-15-12-16(26)8-10-23(15,2)20(17)9-11-24(18,19)3/h4,14,16-20,26H,5-13H2,1-3H3,(H,25,29)(H,27,28)/t14-,16-,17?,18+,19-,20-,23-,24+/m0/s1
KEGG

UniProtKB/SwissProt

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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