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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Inosine Monophosphate Dehydrogenase Type 2 (IMPDH2)' and Monomerid = 50119010   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Inosine Monophosphate Dehydrogenase Type 2 (IMPDH2)


(Homo sapiens (Human))
BDBM50119010
PNG
(Benzo[1,3]dioxole-5-carboxylic acid (3-methoxy-4-o...)
Show SMILES COc1cc(NC(=O)c2ccc3OCOc3c2)ccc1-c1cnco1
Show InChI InChI=1S/C18H14N2O5/c1-22-15-7-12(3-4-13(15)17-8-19-9-23-17)20-18(21)11-2-5-14-16(6-11)25-10-24-14/h2-9H,10H2,1H3,(H,20,21)
PDB
MMDB

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Article
PubMed
n/an/a 330n/an/an/an/an/an/a



Bristol-Myers Squibb PRI

Curated by ChEMBL


Assay Description
Inhibitory activity of compound was evaluated against the Inosine-5'-monophosphate dehydrogenase 2


Bioorg Med Chem Lett 12: 2879-82 (2002)


Article DOI: 10.1016/s0960-894x(02)00601-7
BindingDB Entry DOI: 10.7270/Q29886B5
More data for this
Ligand-Target Pair