Reaction Details |
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Target | Kynurenine 3-monooxygenase |
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Ligand | BDBM50266041 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_1700498 (CHEMBL4051480) |
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IC50 | 3.2±n/a nM |
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Citation | Walker, AL; Ancellin, N; Beaufils, B; Bergeal, M; Binnie, M; Bouillot, A; Clapham, D; Denis, A; Haslam, CP; Holmes, DS; Hutchinson, JP; Liddle, J; McBride, A; Mirguet, O; Mowat, CG; Rowland, P; Tiberghien, N; Trottet, L; Uings, I; Webster, SP; Zheng, X; Mole, DJ Development of a Series of Kynurenine 3-Monooxygenase Inhibitors Leading to a Clinical Candidate for the Treatment of Acute Pancreatitis. J Med Chem60:3383-3404 (2017) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Kynurenine 3-monooxygenase |
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Name: | Kynurenine 3-monooxygenase |
Synonyms: | 1.14.13.9 | KMO_PSEFL | Kynurenine 3-hydroxylase | Kynurenine 3-monooxygenase | PfKMO | kmo | qbsG |
Type: | PROTEIN |
Mol. Mass.: | 50713.22 |
Organism: | Pseudomonas fluorescens |
Description: | ChEMBL_117445 |
Residue: | 461 |
Sequence: | MTATDNARQVTIIGAGLAGTLVARLLARNGWQVNLFERRPDPRIETGARGRSINLALAER
GAHALRLAGLEREVLAEAVMMRGRMVHVPGTPPNLQPYGRDDSEVIWSINRDRLNRILLD
GAEAAGASIHFNLGLDSVDFARQRLTLSNVSGERLEKRFHLLIGADGCNSAVRQAMASVV
DLGEHLETQPHGYKELQITPEASAQFNLEPNALHIWPHGDYMCIALPNLDRSFTVTLFLH
HQSPAAQPASPCFAQLVDGHAARRFFQRQFPDLSPMLDSLEQDFEHHPTGKLATLRLTTW
HVGGQAVLLGDAAHPMVPFHGQGMNCALEDAVALAEHLQSAADNASALAAFTAQRQPDAL
AIQAMALENYVEMSSKVASPTYLLERELGQIMAQRQPTRFIPRYSMVTFSRLPYAQAMAR
GQIQEQLLKFAVANHSDLTSINLDAVEHEVTRCLPPLSHLC
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BDBM50266041 |
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n/a |
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Name | BDBM50266041 |
Synonyms: | CHEMBL4070212 |
Type | Small organic molecule |
Emp. Form. | C17H15ClN2O5 |
Mol. Mass. | 362.764 |
SMILES | C[C@@H](Oc1cc2oc(=O)n(CCC(O)=O)c2cc1Cl)c1ccccn1 |r| |
Structure |
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