| Reaction Details |
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 | Report a problem with these data |
| Target | Cytochrome P450 2B6 |
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| Ligand | BDBM124950 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_1930558 (CHEMBL4433809) |
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| IC50 | 4900±n/a nM |
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| Citation |  Papeo, G; Orsini, P; Avanzi, NR; Borghi, D; Casale, E; Ciomei, M; Cirla, A; Desperati, V; Donati, D; Felder, ER; Galvani, A; Guanci, M; Isacchi, A; Posteri, H; Rainoldi, S; Riccardi-Sirtori, F; Scolaro, A; Montagnoli, A Discovery of Stereospecific PARP-1 Inhibitor Isoindolinone NMS-P515. ACS Med Chem Lett10:534-538 (2019) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| Cytochrome P450 2B6 |
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| Name: | Cytochrome P450 2B6 |
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| Synonyms: | CP2B6_HUMAN | CYP2B6 | Cytochrome P450 2B6 (CYP2B6) |
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| Type: | Protein |
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| Mol. Mass.: | 56289.75 |
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| Organism: | Homo sapiens (Human) |
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| Description: | P20813 |
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| Residue: | 491 |
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| Sequence: | MELSVLLFLALLTGLLLLLVQRHPNTHDRLPPGPRPLPLLGNLLQMDRRGLLKSFLRFRE
KYGDVFTVHLGPRPVVMLCGVEAIREALVDKAEAFSGRGKIAMVDPFFRGYGVIFANGNR
WKVLRRFSVTTMRDFGMGKRSVEERIQEEAQCLIEELRKSKGALMDPTFLFQSITANIIC
SIVFGKRFHYQDQEFLKMLNLFYQTFSLISSVFGQLFELFSGFLKYFPGAHRQVYKNLQE
INAYIGHSVEKHRETLDPSAPKDLIDTYLLHMEKEKSNAHSEFSHQNLNLNTLSLFFAGT
ETTSTTLRYGFLLMLKYPHVAERVYREIEQVIGPHRPPELHDRAKMPYTEAVIYEIQRFS
DLLPMGVPHIVTQHTSFRGYIIPKDTEVFLILSTALHDPHYFEKPDAFNPDHFLDANGAL
KKTEAFIPFSLGKRICLGEGIARAELFLFFTTILQNFSMASPVAPEDIDLTPQECGVGKI
PPTYQIRFLPR
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| BDBM124950 |
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| n/a |
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| Name | BDBM124950 |
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| Synonyms: | US8765972, 3 |
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| Type | Small organic molecule |
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| Emp. Form. | C21H29N3O2 |
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| Mol. Mass. | 355.4739 |
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| SMILES | CC1N(C2CCN(CC2)C2CCCCC2)C(=O)c2c1cccc2C(N)=O |
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| Structure | 
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