BDBM50101976 ASARININ::Episesamin
SMILES: [H][C@]12CO[C@H](c3ccc4OCOc4c3)[C@@]1([H])CO[C@H]2c1ccc2OCOc2c1
InChI Key: InChIKey=PEYUIKBAABKQKQ-WZBLMQSHSA-N
Data: 1 KI
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Cytochrome P450 2C9 (Homo sapiens (Human)) | BDBM50101976 (ASARININ | Episesamin) | PDB MMDB Reactome pathway KEGG B.MOAD DrugBank GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents Similars | Article PubMed | 68 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Toyama Prefectural University Curated by ChEMBL | Assay Description Mechanism-based inhibition of recombinant human CYP2C9 expressed in microsomes isolated from Saccharomyces cerevisiae AH22 cells assessed as diclofen... | Drug Metab Dispos 40: 1917-26 (2012) Article DOI: 10.1124/dmd.112.045906 BindingDB Entry DOI: 10.7270/Q28G8NFN | |||||||||||
More data for this Ligand-Target Pair |