Reaction Details |
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Target | Tyrosyl-DNA phosphodiesterase 1 |
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Ligand | BDBM51138 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_864727 (CHEMBL2174994) |
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IC50 | 40000±n/a nM |
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Citation | Sirivolu, VR; Vernekar, SK; Marchand, C; Naumova, A; Chergui, A; Renaud, A; Stephen, AG; Chen, F; Sham, YY; Pommier, Y; Wang, Z 5-Arylidenethioxothiazolidinones as inhibitors of tyrosyl-DNA phosphodiesterase I. J Med Chem55:8671-84 (2012) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Tyrosyl-DNA phosphodiesterase 1 |
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Name: | Tyrosyl-DNA phosphodiesterase 1 |
Synonyms: | TDP1 | TYDP1_HUMAN | Tyrosyl-DNA phosphodiesterase 1 | Tyrosyl-DNA phosphodiesterase 1 (TDP1) |
Type: | Enzyme |
Mol. Mass.: | 68430.66 |
Organism: | Homo sapiens (Human) |
Description: | Q9NUW8 |
Residue: | 608 |
Sequence: | MSQEGDYGRWTISSSDESEEEKPKPDKPSTSSLLCARQGAANEPRYTCSEAQKAAHKRKI
SPVKFSNTDSVLPPKRQKSGSQEDLGWCLSSSDDELQPEMPQKQAEKVVIKKEKDISAPN
DGTAQRTENHGAPACHRLKEEEDEYETSGEGQDIWDMLDKGNPFQFYLTRVSGVKPKYNS
GALHIKDILSPLFGTLVSSAQFNYCFDVDWLVKQYPPEFRKKPILLVHGDKREAKAHLHA
QAKPYENISLCQAKLDIAFGTHHTKMMLLLYEEGLRVVIHTSNLIHADWHQKTQGIWLSP
LYPRIADGTHKSGESPTHFKADLISYLMAYNAPSLKEWIDVIHKHDLSETNVYLIGSTPG
RFQGSQKDNWGHFRLKKLLKDHASSMPNAESWPVVGQFSSVGSLGADESKWLCSEFKESM
LTLGKESKTPGKSSVPLYLIYPSVENVRTSLEGYPAGGSLPYSIQTAEKQNWLHSYFHKW
SAETSGRSNAMPHIKTYMRPSPDFSKIAWFLVTSANLSKAAWGALEKNGTQLMIRSYELG
VLFLPSAFGLDSFKVKQKFFAGSQEPMATFPVPYDLPPELYGSKDRPWIWNIPYVKAPDT
HGNMWVPS
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BDBM51138 |
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n/a |
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Name | BDBM51138 |
Synonyms: | (5Z)-5-[(1-methyl-3-indolyl)methylidene]-4-sulfanylidene-2-thiazolidinone | (5Z)-5-[(1-methylindol-3-yl)methylene]-4-thioxo-thiazolidin-2-one | (5Z)-5-[(1-methylindol-3-yl)methylidene]-4-sulfanylidene-1,3-thiazolidin-2-one | 5-[(1-methyl-1H-indol-3-yl)methylene]-4-thioxo-1,3-thiazolidin-2-one | MLS000698017 | SMR000225303 | cid_1236521 |
Type | Small organic molecule |
Emp. Form. | C13H10N2OS2 |
Mol. Mass. | 274.361 |
SMILES | Cn1cc(C=C2SC(O)=NC2=S)c2ccccc12 |w:4.3,c:8| |
Structure |
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