BDBM50250996 CHEMBL525240::TANNIN::chebulagic acid::chebulanin
SMILES: O[C@H]1[C@H]2[C@H](CC(O)=O)C(=O)O[C@@H]3[C@H]4COC(=O)c5cc(c(O)c(O)c5O)-c5c(O)c(O)c(O)cc5C(=O)O[C@@H]3[C@@H](OC(=O)c3cc(O)c(O)c(OC1=O)c23)[C@H](OC(=O)c1cc(O)c(O)c(O)c1)O4
InChI Key: InChIKey=KOVTZNCPMJKLDF-UYQHERJPSA-N
Data: 2 IC50
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
DNA topoisomerase I (Topo I) (Homo sapiens (Human)) | BDBM50250996 (CHEMBL525240 | TANNIN | chebulagic acid | chebulan...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Inhibition of human COLO201 cellular topoisomerase-1 mediated plasmid DNA cleavage by electrophoresis in presence of 70 units of enzyme | J Nat Prod 55: 401-413 (1992) Article DOI: 10.1021/np50082a001 BindingDB Entry DOI: 10.7270/Q2542NNP | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
DNA topoisomerase I (Topo I) (Homo sapiens (Human)) | BDBM50250996 (CHEMBL525240 | TANNIN | chebulagic acid | chebulan...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Inhibition of human COLO201 cellular topoisomerase-1 mediated plasmid DNA cleavage by electrophoresis in presence of 14 units of enzyme | J Nat Prod 55: 401-413 (1992) Article DOI: 10.1021/np50082a001 BindingDB Entry DOI: 10.7270/Q2542NNP | |||||||||||
More data for this Ligand-Target Pair |