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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 = 50119124   
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))
BDBM50119124
PNG
(CHEMBL101463 | {3-[N'-(3-Methoxy-4-oxazol-5-yl-phe...)
Show SMILES COc1cc(NC(Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)=NC#N)ccc1-c1cnco1
Show InChI InChI=1S/C24H24N6O5/c1-32-21-10-18(5-6-20(21)22-12-26-15-34-22)30-23(28-14-25)29-17-4-2-3-16(9-17)11-27-24(31)35-19-7-8-33-13-19/h2-6,9-10,12,15,19H,7-8,11,13H2,1H3,(H,27,31)(H2,28,29,30)/t19-/m0/s1
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Article
PubMed
n/an/a 340n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
In vitro inhibition of Inosine-5'-monophosphate dehydrogenase 2.


Bioorg Med Chem Lett 12: 2931-4 (2002)


Article DOI: 10.1016/s0960-894x(02)00600-5
BindingDB Entry DOI: 10.7270/Q2SB454K
More data for this
Ligand-Target Pair