Target
Inosine-5'-monophosphate dehydrogenase 2
Ligand
BDBM50054043
Substrate
n/a
Meas. Tech.
ChEMBL_89808 (CHEMBL698526)
IC50
437.0±n/a nM
Citation
 Nelson, PHCarr, SFDevens, BHEugui, EMFranco, FGonzalez, CHawley, RCLoughhead, DGMilan, DJPapp, EPatterson, JWRouhafza, SSjogren, EBSmith, DBStephenson, RATalamas, FXWaltos, AMWeikert, RJWu, JC Structure-activity relationships for inhibition of inosine monophosphate dehydrogenase by nuclear variants of mycophenolic acid. J Med Chem 39:4181-96 (1996) [PubMed]  Article 
Target
Name:
Inosine-5'-monophosphate dehydrogenase 2
Synonyms:
IMDH2_HUMAN | IMP dehydrogenase 2 | IMPD 2 | IMPD2 | IMPDH-II | IMPDH2 | Inosine 5'-monophosphate dehydrogenase II (IMPDH II) | Inosine Monophosphate Dehydrogenase Type 2 (IMPDH2) | Inosine-5 -monophosphate dehydrogenase 2 | Inosine-5'-monophosphate dehydrogenase (IMPDH)
Type:
Enzyme
Mol. Mass.:
55806.87
Organism:
Homo sapiens (Human)
Description:
Recombinant IMPDH2 expressed in E. coli.
Residue:
514
Sequence:
MADYLISGGTSYVPDDGLTAQQLFNCGDGLTYNDFLILPGYIDFTADQVDLTSALTKKITLKTPLVSSPMDTVTEAGMAIAMALTGGIGFIHHNCTPEFQANEVRKVKKYEQGFITDPVVLSPKDRVRDVFEAKARHGFCGIPITDTGRMGSRLVGIISSRDIDFLKEEEHDCFLEEIMTKREDLVVAPAGITLKEANEILQRSKKGKLPIVNEDDELVAIIARTDLKKNRDYPLASKDAKKQLLCGAAIGTHEDDKYRLDLLAQAGVDVVVLDSSQGNSIFQINMIKYIKDKYPNLQVIGGNVVTAAQAKNLIDAGVDALRVGMGSGSICITQEVLACGRPQATAVYKVSEYARRFGVPVIADGGIQNVGHIAKALALGASTVMMGSLLAATTEAPGEYFFSDGIRLKKYRGMGSLDAMDKHLSSQNRYFSEADKIKVAQGVSGAVQDKGSIHKFVPYLIAGIQHSCQDIGAKSLTQVRAMMYSGELKFEKRTSSAQVEGGVHSLHSYEKRLF
  
Inhibitor
Name:
BDBM50054043
Synonyms:
(E)-6-(3-Chloro-2-fluoro-6-methoxy-4,5-dimethyl-phenyl)-4-methyl-hex-4-enoic acid | CHEMBL337471
Type:
Small organic molecule
Emp. Form.:
C16H20ClFO3
Mol. Mass.:
314.78
SMILES:
COc1c(C)c(C)c(Cl)c(F)c1C\C=C(/C)CCC(O)=O
Structure:
Search PDB for entries with ligand similarity: