Reaction Details |
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Target | Carbonyl reductase [NADPH] 1 |
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Ligand | BDBM50247677 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_495288 (CHEMBL1004505) |
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IC50 | 210±n/a nM |
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Citation | Zimmermann, TJ; Niesen, FH; Pilka, ES; Knapp, S; Oppermann, U; Maier, ME Discovery of a potent and selective inhibitor for human carbonyl reductase 1 from propionate scanning applied to the macrolide zearalenone. Bioorg Med Chem17:530-6 (2009) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Carbonyl reductase [NADPH] 1 |
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Name: | Carbonyl reductase [NADPH] 1 |
Synonyms: | CBR | CBR1 | CBR1_HUMAN | CRN | SDR21C1 |
Type: | PROTEIN |
Mol. Mass.: | 30380.63 |
Organism: | Homo sapiens (Human) |
Description: | ChEMBL_607770 |
Residue: | 277 |
Sequence: | MSSGIHVALVTGGNKGIGLAIVRDLCRLFSGDVVLTARDVTRGQAAVQQLQAEGLSPRFH
QLDIDDLQSIRALRDFLRKEYGGLDVLVNNAGIAFKVADPTPFHIQAEVTMKTNFFGTRD
VCTELLPLIKPQGRVVNVSSIMSVRALKSCSPELQQKFRSETITEEELVGLMNKFVEDTK
KGVHQKEGWPSSAYGVTKIGVTVLSRIHARKLSEQRKGDKILLNACCPGWVRTDMAGPKA
TKSPEEGAETPVYLALLPPDAEGPHGQFVSEKRVEQW
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BDBM50247677 |
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n/a |
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Name | BDBM50247677 |
Synonyms: | (3S,8S)-14,16-dihydroxy-3,8-dimethyl-3,4,5,6,9,10-hexahydro-1H-benzo[c][1]oxacyclotetradecine-1,7(8H)-dione | CHEMBL453375 |
Type | Small organic molecule |
Emp. Form. | C19H24O5 |
Mol. Mass. | 332.3909 |
SMILES | C[C@H]1CCCC(=O)[C@@H](C)CC\C=C\c2cc(O)cc(O)c2C(=O)O1 |r,t:11| |
Structure |
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