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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Inosine Monophosphate Dehydrogenase Type 2 (IMPDH2)' and Monomerid = 50275685   
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))
BDBM50275685
PNG
((E)-6-(2,4-dimethoxy-5-(oxazol-5-yl)phenyl)-4-meth...)
Show SMILES COc1cc(OC)c(cc1C\C=C(/C)CCC(O)=O)-c1cnco1
Show InChI InChI=1S/C18H21NO5/c1-12(5-7-18(20)21)4-6-13-8-14(17-10-19-11-24-17)16(23-3)9-15(13)22-2/h4,8-11H,5-7H2,1-3H3,(H,20,21)/b12-4+
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PC cid
PC sid
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Similars

Article
PubMed
2.30E+3n/an/an/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Inhibition of human IMPDH2


Bioorg Med Chem 16: 9340-5 (2008)


Article DOI: 10.1016/j.bmc.2008.08.062
BindingDB Entry DOI: 10.7270/Q2K937BH
More data for this
Ligand-Target Pair
Inosine Monophosphate Dehydrogenase Type 2 (IMPDH2)


(Homo sapiens (Human))
BDBM50275685
PNG
((E)-6-(2,4-dimethoxy-5-(oxazol-5-yl)phenyl)-4-meth...)
Show SMILES COc1cc(OC)c(cc1C\C=C(/C)CCC(O)=O)-c1cnco1
Show InChI InChI=1S/C18H21NO5/c1-12(5-7-18(20)21)4-6-13-8-14(17-10-19-11-24-17)16(23-3)9-15(13)22-2/h4,8-11H,5-7H2,1-3H3,(H,20,21)/b12-4+
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
4.30E+3n/an/an/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Inhibition of human IMPDH2


Bioorg Med Chem 16: 9340-5 (2008)


Article DOI: 10.1016/j.bmc.2008.08.062
BindingDB Entry DOI: 10.7270/Q2K937BH
More data for this
Ligand-Target Pair