| Reaction Details |
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 | Report a problem with these data |
| Target | Double-strand break repair protein MRE11 |
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| Ligand | BDBM573129 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | HTS Assay |
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| IC50 | <2000±n/a nM |
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| Citation |  Paruch, K; Carbain, B; Havel, S; Vsiansky, V; Nikulenkov, F; Krejci, L Substituted propanamides as inhibitors of nucleases US Patent US11453663 Publication Date 9/27/2022 |
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| More Info.: | Get all data from this article, Assay Method |
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| Double-strand break repair protein MRE11 |
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| Name: | Double-strand break repair protein MRE11 |
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| Synonyms: | Double-strand break repair protein MRE11A | HNGS1 | HNGS1 | MRE11 | MRE11 homolog 1 | MRE11 homolog A | MRE11A | MRE11_HUMAN | Meiotic recombination 11 homolog 1 | Meiotic recombination 11 homolog A |
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| Type: | PROTEIN |
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| Mol. Mass.: | 80583.26 |
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| Organism: | Homo sapiens (Human) |
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| Description: | ChEMBL_109117 |
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| Residue: | 708 |
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| Sequence: | MSTADALDDENTFKILVATDIHLGFMEKDAVRGNDTFVTLDEILRLAQENEVDFILLGGD
LFHENKPSRKTLHTCLELLRKYCMGDRPVQFEILSDQSVNFGFSKFPWVNYQDGNLNISI
PVFSIHGNHDDPTGADALCALDILSCAGFVNHFGRSMSVEKIDISPVLLQKGSTKIALYG
LGSIPDERLYRMFVNKKVTMLRPKEDENSWFNLFVIHQNRSKHGSTNFIPEQFLDDFIDL
VIWGHEHECKIAPTKNEQQLFYISQPGSSVVTSLSPGEAVKKHVGLLRIKGRKMNMHKIP
LHTVRQFFMEDIVLANHPDIFNPDNPKVTQAIQSFCLEKIEEMLENAERERLGNSHQPEK
PLVRLRVDYSGGFEPFSVLRFSQKFVDRVANPKDIIHFFRHREQKEKTGEEINFGKLITK
PSEGTTLRVEDLVKQYFQTAEKNVQLSLLTERGMGEAVQEFVDKEEKDAIEELVKYQLEK
TQRFLKERHIDALEDKIDEEVRRFRETRQKNTNEEDDEVREAMTRARALRSQSEESASAF
SADDLMSIDLAEQMANDSDDSISAATNKGRGRGRGRRGGRGQNSASRGGSQRGRADTGLE
TSTRSRNSKTAVSASRNMSIIDAFKSTRQQPSRNVTTKNYSEVIEVDESDVEEDIFPTTS
KTDQRWSSTSSSKIMSQSQVSKGVDFESSEDDDDDPFMNTSSLRRNRR
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| BDBM573129 |
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| n/a |
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| Name | BDBM573129 |
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| Synonyms: | 2-cyano-3-(3,4-dihydroxyphenyl)-N-(4-(3-fluoropyridin-2-yl)thiazol-2-yl)propanamide | US11453663, Preparative Example 172 |
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| Type | Small organic molecule |
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| Emp. Form. | C18H13FN4O3S |
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| Mol. Mass. | 384.384 |
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| SMILES | Oc1ccc(CC(C#N)C(=O)Nc2nc(cs2)-c2ncccc2F)cc1O |
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| Structure | 
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