| Reaction Details |
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 | Report a problem with these data |
| Target | DNA topoisomerase 1 |
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| Ligand | BDBM50557284 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_2058656 (CHEMBL4713657) |
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| IC50 | 7200±n/a nM |
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| Citation |  Hsueh, WY; Lee, YE; Huang, MS; Lai, CH; Gao, YS; Lin, JC; Chen, YF; Chang, CL; Chou, SY; Chen, SF; Lu, YY; Chang, LH; Lin, SF; Lin, YH; Hsu, PC; Wei, WY; Huang, YC; Kao, YF; Teng, LW; Liu, HH; Chen, YC; Yuan, TT; Chan, YW; Huang, PH; Chao, YT; Huang, SY; Jian, BH; Huang, HY; Yang, SC; Lo, TH; Huang, GR; Wang, SY; Lin, HS; Chuang, SH; Huang, JJ Copper(I)-Catalyzed Nitrile-Addition/ J Med Chem64:1435-1453 (2021) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| DNA topoisomerase 1 |
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| Name: | DNA topoisomerase 1 |
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| Synonyms: | DNA topoisomerase I | DNA topoisomerase I (Topo I) | TOP1 | TOP1_HUMAN |
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| Type: | Enzyme |
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| Mol. Mass.: | 90771.02 |
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| Organism: | Homo sapiens (Human) |
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| Description: | P11387 |
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| Residue: | 765 |
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| Sequence: | MSGDHLHNDSQIEADFRLNDSHKHKDKHKDREHRHKEHKKEKDREKSKHSNSEHKDSEKK
HKEKEKTKHKDGSSEKHKDKHKDRDKEKRKEEKVRASGDAKIKKEKENGFSSPPQIKDEP
EDDGYFVPPKEDIKPLKRPRDEDDADYKPKKIKTEDTKKEKKRKLEEEEDGKLKKPKNKD
KDKKVPEPDNKKKKPKKEEEQKWKWWEEERYPEGIKWKFLEHKGPVFAPPYEPLPENVKF
YYDGKVMKLSPKAEEVATFFAKMLDHEYTTKEIFRKNFFKDWRKEMTNEEKNIITNLSKC
DFTQMSQYFKAQTEARKQMSKEEKLKIKEENEKLLKEYGFCIMDNHKERIANFKIEPPGL
FRGRGNHPKMGMLKRRIMPEDIIINCSKDAKVPSPPPGHKWKEVRHDNKVTWLVSWTENI
QGSIKYIMLNPSSRIKGEKDWQKYETARRLKKCVDKIRNQYREDWKSKEMKVRQRAVALY
FIDKLALRAGNEKEEGETADTVGCCSLRVEHINLHPELDGQEYVVEFDFLGKDSIRYYNK
VPVEKRVFKNLQLFMENKQPEDDLFDRLNTGILNKHLQDLMEGLTAKVFRTYNASITLQQ
QLKELTAPDENIPAKILSYNRANRAVAILCNHQRAPPKTFEKSMMNLQTKIDAKKEQLAD
ARRDLKSAKADAKVMKDAKTKKVVESKKKAVQRLEEQLMKLEVQATDREENKQIALGTSK
LNYLDPRITVAWCKKWGVPIEKIYNKTQREKFAWAIDMADEDYEF
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| BDBM50557284 |
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| n/a |
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| Name | BDBM50557284 |
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| Synonyms: | CHEMBL4789468 |
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| Type | Small organic molecule |
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| Emp. Form. | C24H27ClN4O3 |
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| Mol. Mass. | 454.949 |
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| SMILES | CN(C)CCn1c2cc3OCOc3cc2c2c1c1ccc(Cl)cc1n(CCN(C)C)c2=O |
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| Structure | 
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