BDBM50130203 ALLOCRYPTOPINE::Allocryptopine::Allocrytopine::CHEBI:17390
SMILES: COc1ccc2CC(=O)c3cc4OCOc4cc3CCN(C)Cc2c1OC
InChI Key: InChIKey=HYBRYAPKQCZIAE-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 2D6 (Homo sapiens (Human)) | BDBM50130203 (ALLOCRYPTOPINE | Allocryptopine | Allocrytopine | ...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet | Purchase MCE KEGG PC cid PC sid UniChem Patents Similars | PubMed | 122 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois College of Pharmacy Curated by ChEMBL | Assay Description Competitive inhibition of CYP2D6 (unknown origin) using dextromethorphan substrate | J Med Chem 58: 8360-72 (2015) BindingDB Entry DOI: 10.7270/Q29Z96QC | |||||||||||
More data for this Ligand-Target Pair |