Found 6 hits for monomerid = 50310801 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 |
EBifunctional epoxide hydrolase 2
(Homo sapiens (Human)) | BDBM50310801
(3-(3-amino-3-oxopropyl)-N-(4-chlorophenyl)-3-pheny...)Show SMILES NC(=O)CCC1(CCCN(C1)C(=O)Nc1ccc(Cl)cc1)c1ccccc1 Show InChI InChI=1S/C21H24ClN3O2/c22-17-7-9-18(10-8-17)24-20(27)25-14-4-12-21(15-25,13-11-19(23)26)16-5-2-1-3-6-16/h1-3,5-10H,4,11-15H2,(H2,23,26)(H,24,27) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of human soluble epoxide hydrolase |
Bioorg Med Chem Lett 19: 5314-20 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.138 BindingDB Entry DOI: 10.7270/Q2S75GFP |
More data for this Ligand-Target Pair | |
Epoxide hydrolase 2
(Rattus norvegicus) | BDBM50310801
(3-(3-amino-3-oxopropyl)-N-(4-chlorophenyl)-3-pheny...)Show SMILES NC(=O)CCC1(CCCN(C1)C(=O)Nc1ccc(Cl)cc1)c1ccccc1 Show InChI InChI=1S/C21H24ClN3O2/c22-17-7-9-18(10-8-17)24-20(27)25-14-4-12-21(15-25,13-11-19(23)26)16-5-2-1-3-6-16/h1-3,5-10H,4,11-15H2,(H2,23,26)(H,24,27) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 26 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of rat soluble epoxide hydrolase |
Bioorg Med Chem Lett 19: 5314-20 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.138 BindingDB Entry DOI: 10.7270/Q2S75GFP |
More data for this Ligand-Target Pair | |
Cytochrome P450 3A4
(Homo sapiens (Human)) | BDBM50310801
(3-(3-amino-3-oxopropyl)-N-(4-chlorophenyl)-3-pheny...)Show SMILES NC(=O)CCC1(CCCN(C1)C(=O)Nc1ccc(Cl)cc1)c1ccccc1 Show InChI InChI=1S/C21H24ClN3O2/c22-17-7-9-18(10-8-17)24-20(27)25-14-4-12-21(15-25,13-11-19(23)26)16-5-2-1-3-6-16/h1-3,5-10H,4,11-15H2,(H2,23,26)(H,24,27) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of CYP3A4 |
Bioorg Med Chem Lett 19: 5314-20 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.138 BindingDB Entry DOI: 10.7270/Q2S75GFP |
More data for this Ligand-Target Pair | |
Cytochrome P450 2C9
(Homo sapiens (Human)) | BDBM50310801
(3-(3-amino-3-oxopropyl)-N-(4-chlorophenyl)-3-pheny...)Show SMILES NC(=O)CCC1(CCCN(C1)C(=O)Nc1ccc(Cl)cc1)c1ccccc1 Show InChI InChI=1S/C21H24ClN3O2/c22-17-7-9-18(10-8-17)24-20(27)25-14-4-12-21(15-25,13-11-19(23)26)16-5-2-1-3-6-16/h1-3,5-10H,4,11-15H2,(H2,23,26)(H,24,27) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of CYP2C9 |
Bioorg Med Chem Lett 19: 5314-20 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.138 BindingDB Entry DOI: 10.7270/Q2S75GFP |
More data for this Ligand-Target Pair | |
Cytochrome P450 2D6
(Homo sapiens (Human)) | BDBM50310801
(3-(3-amino-3-oxopropyl)-N-(4-chlorophenyl)-3-pheny...)Show SMILES NC(=O)CCC1(CCCN(C1)C(=O)Nc1ccc(Cl)cc1)c1ccccc1 Show InChI InChI=1S/C21H24ClN3O2/c22-17-7-9-18(10-8-17)24-20(27)25-14-4-12-21(15-25,13-11-19(23)26)16-5-2-1-3-6-16/h1-3,5-10H,4,11-15H2,(H2,23,26)(H,24,27) | PDB
UniProtKB/SwissProt UniProtKB/TrEMBL
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of CYP2D6 |
Bioorg Med Chem Lett 19: 5314-20 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.138 BindingDB Entry DOI: 10.7270/Q2S75GFP |
More data for this Ligand-Target Pair | |
Epoxide hydrolase 1
(Homo sapiens (Human)) | BDBM50310801
(3-(3-amino-3-oxopropyl)-N-(4-chlorophenyl)-3-pheny...)Show SMILES NC(=O)CCC1(CCCN(C1)C(=O)Nc1ccc(Cl)cc1)c1ccccc1 Show InChI InChI=1S/C21H24ClN3O2/c22-17-7-9-18(10-8-17)24-20(27)25-14-4-12-21(15-25,13-11-19(23)26)16-5-2-1-3-6-16/h1-3,5-10H,4,11-15H2,(H2,23,26)(H,24,27) | KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of human microsomal epoxide hydrolase |
Bioorg Med Chem Lett 19: 5314-20 (2009)
Article DOI: 10.1016/j.bmcl.2009.07.138 BindingDB Entry DOI: 10.7270/Q2S75GFP |
More data for this Ligand-Target Pair | |