Reaction Details |
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Target | Inosine-5'-monophosphate dehydrogenase 1 |
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Ligand | BDBM50331098 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_686239 (CHEMBL1292995) |
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IC50 | 4100±n/a nM |
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Citation | Mitsuhashi, S; Takenaka, J; Iwamori, K; Nakajima, N; Ubukata, M Structure-activity relationships for inhibition of inosine monophosphate dehydrogenase and differentiation induction of K562 cells among the mycophenolic acid derivatives. Bioorg Med Chem18:8106-11 (2010) [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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BDBM50331098 |
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n/a |
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Name | BDBM50331098 |
Synonyms: | 6-(4-acetoxy-6-methoxy-7-methyl-3-oxo-1,3-dihydroisobenzofuran-5-yl)-4-methylhex-4-enoic acid | CHEMBL238403 |
Type | Small organic molecule |
Emp. Form. | C19H22O7 |
Mol. Mass. | 362.3738 |
SMILES | COc1c(C)c2COC(=O)c2c(OC(C)=O)c1C\C=C(/C)CCC(O)=O |
Structure |
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