BDBM50273783 (2-(Pyridin-3-yl)quinolin-4-yl)(4-(pyrrolidin-1-yl)piperidin-1-yl)methanone::CHEMBL515522
SMILES: O=C(N1CCC(CC1)N1CCCC1)c1cc(nc2ccccc12)-c1cccnc1
InChI Key: InChIKey=XJYQGVZXEQCTBM-UHFFFAOYSA-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)) | BDBM50273783 ((2-(Pyridin-3-yl)quinolin-4-yl)(4-(pyrrolidin-1-yl...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 2.41E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Washington State University Curated by ChEMBL | Assay Description Inhibition of reconstituted CYP2C9 (unknown origin) | J Med Chem 51: 8000-11 (2008) Article DOI: 10.1021/jm8011257 BindingDB Entry DOI: 10.7270/Q2K937CZ | |||||||||||
More data for this Ligand-Target Pair |