Reaction Details |
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Target | Tryptophan 2,3-dioxygenase |
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Ligand | BDBM50514752 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_1858295 (CHEMBL4359024) |
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IC50 | 32300±n/a nM |
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Citation | Serafini, M; Torre, E; Aprile, S; Grosso, ED; Gesł, A; Griglio, A; Colombo, G; Travelli, C; Paiella, S; Adamo, A; Orecchini, E; Coletti, A; Pallotta, MT; Ugel, S; Massarotti, A; Pirali, T; Fallarini, S Discovery of Highly Potent Benzimidazole Derivatives as Indoleamine 2,3-Dioxygenase-1 (IDO1) Inhibitors: From Structure-Based Virtual Screening to J Med Chem63:3047-3065 (2020) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Tryptophan 2,3-dioxygenase |
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Name: | Tryptophan 2,3-dioxygenase |
Synonyms: | T23O_MOUSE | TO | TRPO | Tdo | Tdo2 | Tryptamin 2,3-dioxygenase | Tryptophan oxygenase | Tryptophan pyrrolase | Tryptophanase |
Type: | PROTEIN |
Mol. Mass.: | 47757.90 |
Organism: | Mus musculus |
Description: | ChEMBL_1452150 |
Residue: | 406 |
Sequence: | MSGCPFAGNSVGYTLKNVSMEDNEEDRAQTGVNRASKGGLIYGNYLQLEKILNAQELQSE
VKGNKIHDEHLFIITHQAYELWFKQILWELDSVREIFQNGHVRDERNMLKVIARMHRVVV
IFKLLVQQFSVLETMTALDFNDFREYLSPASGFQSLQFRLLENKIGVLQSLRVPYNRKHY
RDNFGGDYNELLLKSEQEQTLLQLVEAWLERTPGLEPNGFNFWGKFEKNILKGLEEEFLR
IQAKTDSEEKEEQMAEFRKQKEVLLCLFDEKRHDYLLSKGERRLSYRALQGALMIYFYRE
EPRFQVPFQLLTSLMDIDTLMTKWRYNHVCMVHRMLGTKAGTGGSSGYHYLRSTVSDRYK
VFVDLFNLSTYLVPRHWVPKMNPIIHKFLYTAEYSDSSYFSSDESD
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BDBM50514752 |
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n/a |
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Name | BDBM50514752 |
Synonyms: | CHEMBL4458549 |
Type | Small organic molecule |
Emp. Form. | C23H18N4O |
Mol. Mass. | 366.4152 |
SMILES | O=C(NCc1cccc(Cn2cnc3ccccc23)c1)c1ccc(cc1)C#N |
Structure |
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