Found 5 hits for monomerid = 50301831 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 1A
(Homo sapiens (Human)) | BDBM50301831
(CHEMBL583442 | N-(4-(difluoromethoxy)benzyl)-2-(3-...)Show SMILES CC1(CC(=O)NCc2ccc(OC(F)F)cc2)CC2(CCCCC2)OO1 Show InChI InChI=1S/C19H25F2NO4/c1-18(13-19(26-25-18)9-3-2-4-10-19)11-16(23)22-12-14-5-7-15(8-6-14)24-17(20)21/h5-8,17H,2-4,9-13H2,1H3,(H,22,23) | PDB MMDB
Reactome pathway KEGG
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute Infectious Diseases Initiative
Curated by ChEMBL
| Assay Description Inhibition of human CYP1A2 |
Bioorg Med Chem Lett 19: 5657-60 (2009)
Article DOI: 10.1016/j.bmcl.2009.08.024 BindingDB Entry DOI: 10.7270/Q22R3RRX |
More data for this Ligand-Target Pair | |
Cytochrome P450 2C9
(Homo sapiens (Human)) | BDBM50301831
(CHEMBL583442 | N-(4-(difluoromethoxy)benzyl)-2-(3-...)Show SMILES CC1(CC(=O)NCc2ccc(OC(F)F)cc2)CC2(CCCCC2)OO1 Show InChI InChI=1S/C19H25F2NO4/c1-18(13-19(26-25-18)9-3-2-4-10-19)11-16(23)22-12-14-5-7-15(8-6-14)24-17(20)21/h5-8,17H,2-4,9-13H2,1H3,(H,22,23) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute Infectious Diseases Initiative
Curated by ChEMBL
| Assay Description Inhibition of human CYP2C9 |
Bioorg Med Chem Lett 19: 5657-60 (2009)
Article DOI: 10.1016/j.bmcl.2009.08.024 BindingDB Entry DOI: 10.7270/Q22R3RRX |
More data for this Ligand-Target Pair | |
Cytochrome P450 2D6
(Homo sapiens (Human)) | BDBM50301831
(CHEMBL583442 | N-(4-(difluoromethoxy)benzyl)-2-(3-...)Show SMILES CC1(CC(=O)NCc2ccc(OC(F)F)cc2)CC2(CCCCC2)OO1 Show InChI InChI=1S/C19H25F2NO4/c1-18(13-19(26-25-18)9-3-2-4-10-19)11-16(23)22-12-14-5-7-15(8-6-14)24-17(20)21/h5-8,17H,2-4,9-13H2,1H3,(H,22,23) | PDB
UniProtKB/SwissProt UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute Infectious Diseases Initiative
Curated by ChEMBL
| Assay Description Inhibition of human CYP2D6 |
Bioorg Med Chem Lett 19: 5657-60 (2009)
Article DOI: 10.1016/j.bmcl.2009.08.024 BindingDB Entry DOI: 10.7270/Q22R3RRX |
More data for this Ligand-Target Pair | |
Cytochrome P450 3A4
(Homo sapiens (Human)) | BDBM50301831
(CHEMBL583442 | N-(4-(difluoromethoxy)benzyl)-2-(3-...)Show SMILES CC1(CC(=O)NCc2ccc(OC(F)F)cc2)CC2(CCCCC2)OO1 Show InChI InChI=1S/C19H25F2NO4/c1-18(13-19(26-25-18)9-3-2-4-10-19)11-16(23)22-12-14-5-7-15(8-6-14)24-17(20)21/h5-8,17H,2-4,9-13H2,1H3,(H,22,23) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute Infectious Diseases Initiative
Curated by ChEMBL
| Assay Description Inhibition of human CYP3A4 |
Bioorg Med Chem Lett 19: 5657-60 (2009)
Article DOI: 10.1016/j.bmcl.2009.08.024 BindingDB Entry DOI: 10.7270/Q22R3RRX |
More data for this Ligand-Target Pair | |
Cytochrome P450 2C19
(Homo sapiens (Human)) | BDBM50301831
(CHEMBL583442 | N-(4-(difluoromethoxy)benzyl)-2-(3-...)Show SMILES CC1(CC(=O)NCc2ccc(OC(F)F)cc2)CC2(CCCCC2)OO1 Show InChI InChI=1S/C19H25F2NO4/c1-18(13-19(26-25-18)9-3-2-4-10-19)11-16(23)22-12-14-5-7-15(8-6-14)24-17(20)21/h5-8,17H,2-4,9-13H2,1H3,(H,22,23) | 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 | 4.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute Infectious Diseases Initiative
Curated by ChEMBL
| Assay Description Inhibition of human CYP2C19 |
Bioorg Med Chem Lett 19: 5657-60 (2009)
Article DOI: 10.1016/j.bmcl.2009.08.024 BindingDB Entry DOI: 10.7270/Q22R3RRX |
More data for this Ligand-Target Pair | |