Reaction Details Report a problem with these data
Target
DNA topoisomerase I
Ligand
BDBM50529605
Substrate
n/a
Meas. Tech.
ChEMBL_1909011 (CHEMBL4411457)
IC50
23000±n/a nM
Citation
 Li, SJ; Zhang, X; Wang, XH; Zhao, CQ Novel natural compounds from endophytic fungi with anticancer activity. Eur J Med Chem 156:316-343 (2018) [PubMed]  Article 
Target
Name:
DNA topoisomerase I
Synonyms:
5.6.2.1 | DNA topoisomerase 1 | DNA topoisomerase I | TOP1
Type:
PROTEIN
Mol. Mass.:
89735.02
Organism:
Bos taurus
Description:
ChEMBL_119672
Residue:
757
Sequence:
DSSLMVADSHKHKDKHKDREHRHKEHKKDKEKDREKSKHSNSEHKDSEKKHKEKEKTKHKDGSSEKHKDKHKDRDKEKRKEEKIKASGDAKIKKEKENGFSSPPRIKDEPEDDGYFAPPKEDIKPLKRPRDEDDADYKPKKIKTEDIKKEKKRKLEEEEDGKLKKPKNKDKDKDKKVPEPDSKKKKPKKEEEQKWKWWEEERYPEGIKWKFLEHKGPVFAPPYEPLPENVKFYYDGKVMKLSPKAEEVATFFAKMLDHEYTTKEIFRKNFFKDWRKEMTNEEKNIITNLSKCDFTQMSQYFKAQTEARKQMSKEEKLKIKEENEKLLKEYGFCVMDNHRERIANFKIEPPGLFRGRGNHPKMGMLKRRIMPEDIIINCSKDAKVPSPPPGHKWKEVRHDNKVTWLVSWTENIQGSIKYIMLNPSSRIKGEKDWQKYETARRLKKCVDKIRNQYREDWKSKEMKVRQRAVALYFIDKLALRAGNEKEEGETADTVGCCSLRVEHINLHPELDGQEYVVEFDFLGKDSIRYYNKVPVEKRVFKNLQLFMENKQPEDDLFDRLNTGILNKHLQDLMEGLTAKVFRTYNASITLQQQLKELTAPDENIPAKILSYNRANRAVAILCNHQRAPPKTFEKSMMNLQSKIDAKKEQLADARRDLKSAKADAKVLKDAKTKKVVESKKKAVQRLEEQLMKLEVQATDREENKQIALGTSKLNYLDPRITVAWCKKWGVPIEKIYNKTQREKFAWAIDMADEDYEF
  
Inhibitor
Name:
BDBM50529605
Synonyms:
CHEMBL4569028
Type:
Small organic molecule
Emp. Form.:
C15H16O5
Mol. Mass.:
276.2845
SMILES:
[H][C@]12C=C[C@H](O)[C@@H](O)[C@]1([H])C(=O)c1c(O)cc(C)cc1[C@@H]2O |r,c:2|
Structure:
Search PDB for entries with ligand similarity: