BDBM50183242 3-(6-((1R,2R)-1-(1H-imidazol-1-yl)-2-morpholinopropyl)naphthalen-2-yloxy)-2,2-dimethylpropanoic acid::CHEMBL208158
SMILES: C[C@H]([C@@H](c1ccc2cc(OCC(C)(C)C(O)=O)ccc2c1)n1ccnc1)N1CCOCC1
InChI Key: InChIKey=ATTJXWVUQQZVGI-JPYJTQIMSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Cytochrome P450 3A4 (Homo sapiens (Human)) | BDBM50183242 (3-(6-((1R,2R)-1-(1H-imidazol-1-yl)-2-morpholinopro...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 2.15E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
OSI Pharmaceuticals, Inc. Curated by ChEMBL | Assay Description Inhibition of CYP3A4 | Bioorg Med Chem Lett 16: 2729-33 (2006) Article DOI: 10.1016/j.bmcl.2006.02.020 BindingDB Entry DOI: 10.7270/Q24Q7TK9 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cytochrome P450 26A1 (Homo sapiens (Human)) | BDBM50183242 (3-(6-((1R,2R)-1-(1H-imidazol-1-yl)-2-morpholinopro...) | Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 34 | n/a | n/a | n/a | n/a | n/a | n/a |
OSI Pharmaceuticals, Inc. Curated by ChEMBL | Assay Description Inhibition of CYP26 expressed in human T47D cell line | Bioorg Med Chem Lett 16: 2729-33 (2006) Article DOI: 10.1016/j.bmcl.2006.02.020 BindingDB Entry DOI: 10.7270/Q24Q7TK9 | |||||||||||
More data for this Ligand-Target Pair |