null
SMILES: O\C(=C/C(=O)c1cc(Cc2cc(F)cc(F)c2)cn(Cc2ccccc2F)c1=O)C(=O)N1CCN(CC1)c1ccc(cc1)-n1cccc1
InChI Key: InChIKey=FVQZBYCHVJMDDI-QHDYCIAZSA-N
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)) | BDBM50103451 (CHEMBL3398252) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | >1.85E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Georgia Curated by ChEMBL | Assay Description Inhibition of CYP3D6 in pooled mixed-gender human liver microsomes using dextromethorphan substrate in presence of NADPH pre-incubated for 3 mins by ... | Bioorg Med Chem Lett 25: 1269-73 (2015) Article DOI: 10.1016/j.bmcl.2015.01.050 BindingDB Entry DOI: 10.7270/Q2KW5HTQ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cytochrome P450 3A4 (Homo sapiens (Human)) | BDBM50103451 (CHEMBL3398252) | 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 | >8.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Georgia Curated by ChEMBL | Assay Description Inhibition of CYP3A4 in pooled mixed-gender human liver microsomes using triazolam substrate in presence of NADPH pre-incubated for 3 mins by HPLC-UV... | Bioorg Med Chem Lett 25: 1269-73 (2015) Article DOI: 10.1016/j.bmcl.2015.01.050 BindingDB Entry DOI: 10.7270/Q2KW5HTQ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cytochrome P450 3A4 (Homo sapiens (Human)) | BDBM50103451 (CHEMBL3398252) | 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 | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Georgia Curated by ChEMBL | Assay Description Inhibition of CYP3A4 in pooled mixed-gender human liver microsomes using testosterone substrate in presence of NADPH pre-incubated for 3 mins by HPLC... | Bioorg Med Chem Lett 25: 1269-73 (2015) Article DOI: 10.1016/j.bmcl.2015.01.050 BindingDB Entry DOI: 10.7270/Q2KW5HTQ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
UDP-glucuronosyltransferase 1A1 (Homo sapiens (Human)) | BDBM50103451 (CHEMBL3398252) | UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | >3.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Georgia Curated by ChEMBL | Assay Description Inhibition of of UGT1A1 in pooled mixed-gender human liver microsomes using 4-methylumbelliferone substrate by HPLC method | Bioorg Med Chem Lett 25: 1269-73 (2015) Article DOI: 10.1016/j.bmcl.2015.01.050 BindingDB Entry DOI: 10.7270/Q2KW5HTQ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
UDP-glucuronosyltransferase 1A9 (Homo sapiens (Human)) | BDBM50103451 (CHEMBL3398252) | Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | >3.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Georgia Curated by ChEMBL | Assay Description Inhibition of of UGT1A9 in pooled mixed-gender human liver microsomes using 4-methylumbelliferone substrate by HPLC method | Bioorg Med Chem Lett 25: 1269-73 (2015) Article DOI: 10.1016/j.bmcl.2015.01.050 BindingDB Entry DOI: 10.7270/Q2KW5HTQ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
UDP-glucuronosyltransferase 1-6 (Homo sapiens (Human)) | BDBM50103451 (CHEMBL3398252) | UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | >3.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Georgia Curated by ChEMBL | Assay Description Inhibition of of UGT1A6 in pooled mixed-gender human liver microsomes using 4-methylumbelliferone substrate by HPLC method | Bioorg Med Chem Lett 25: 1269-73 (2015) Article DOI: 10.1016/j.bmcl.2015.01.050 BindingDB Entry DOI: 10.7270/Q2KW5HTQ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
UDP-glucuronosyltransferase 2B7 (Homo sapiens (Human)) | BDBM50103451 (CHEMBL3398252) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | >3.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Georgia Curated by ChEMBL | Assay Description Inhibition of of UGT3B7 in pooled mixed-gender human liver microsomes using 4-methylumbelliferone substrate by HPLC method | Bioorg Med Chem Lett 25: 1269-73 (2015) Article DOI: 10.1016/j.bmcl.2015.01.050 BindingDB Entry DOI: 10.7270/Q2KW5HTQ | |||||||||||
More data for this Ligand-Target Pair |