Reaction Details |
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Target | Inosine-5'-monophosphate dehydrogenase 1 |
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Ligand | BDBM50338543 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_728668 (CHEMBL1685945) |
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Ki | 99±n/a nM |
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Citation | Felczak, K; Chen, L; Wilson, D; Williams, J; Vince, R; Petrelli, R; Jayaram, HN; Kusumanchi, P; Kumar, M; Pankiewicz, KW Cofactor-type inhibitors of inosine monophosphate dehydrogenase via modular approach: targeting the pyrophosphate binding sub-domain. Bioorg Med Chem19:1594-605 (2011) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Inosine-5'-monophosphate dehydrogenase 1 |
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Name: | Inosine-5'-monophosphate dehydrogenase 1 |
Synonyms: | IMDH1_HUMAN | IMP dehydrogenase 1 | IMPD 1 | IMPD1 | IMPDH-I | IMPDH1 | Inosine Monophosphate Dehydrogenase Type 1 (IMPDH1) | Inosine-5'-monophosphate dehydrogenase (IMPDH) |
Type: | Enzyme |
Mol. Mass.: | 55407.70 |
Organism: | Homo sapiens (Human) |
Description: | Recombinant IMPDH1 expressed in E. coli. |
Residue: | 514 |
Sequence: | MADYLISGGTGYVPEDGLTAQQLFASADGLTYNDFLILPGFIDFIADEVDLTSALTRKIT
LKTPLISSPMDTVTEADMAIAMALMGGIGFIHHNCTPEFQANEVRKVKKFEQGFITDPVV
LSPSHTVGDVLEAKMRHGFSGIPITETGTMGSKLVGIVTSRDIDFLAEKDHTTLLSEVMT
PRIELVVAPAGVTLKEANEILQRSKKGKLPIVNDCDELVAIIARTDLKKNRDYPLASKDS
QKQLLCGAAVGTREDDKYRLDLLTQAGVDVIVLDSSQGNSVYQIAMVHYIKQKYPHLQVI
GGNVVTAAQAKNLIDAGVDGLRVGMGCGSICITQEVMACGRPQGTAVYKVAEYARRFGVP
IIADGGIQTVGHVVKALALGASTVMMGSLLAATTEAPGEYFFSDGVRLKKYRGMGSLDAM
EKSSSSQKRYFSEGDKVKIAQGVSGSIQDKGSIQKFVPYLIAGIQHGCQDIGARSLSVLR
SMMYSGELKFEKRTMSAQIEGGVHGLHSYEKRLY
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BDBM50338543 |
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n/a |
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Name | BDBM50338543 |
Synonyms: | CHEMBL1683745 | Mycophenolic 2-ethyladenosin-5'-yl-ethylenebis(phosphonate) |
Type | Small organic molecule |
Emp. Form. | C26H35N5O13P2 |
Mol. Mass. | 687.5293 |
SMILES | CCc1nc(N)c2ncn([C@H]3O[C@@H](COP(O)(=O)CCP(O)(=O)OCCc4c(O)c5C(=O)OCc5c(C)c4OC)[C@H](O)[C@@H]3O)c2n1 |r| |
Structure |
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