Found 3 hits for monomerid = 50174965 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 |
Kappa-type opioid receptor
(Homo sapiens (Human)) | BDBM50174965
(5-Methylsulfamoyl-2,3-dihydro-benzofuran-2-carboxy...)Show SMILES CNS(=O)(=O)c1ccc2OC(Cc2c1)C(=O)N(C)[C@H](CN1CC[C@H](O)C1)c1ccccc1 Show InChI InChI=1S/C23H29N3O5S/c1-24-32(29,30)19-8-9-21-17(12-19)13-22(31-21)23(28)25(2)20(16-6-4-3-5-7-16)15-26-11-10-18(27)14-26/h3-9,12,18,20,22,24,27H,10-11,13-15H2,1-2H3/t18-,20+,22?/m0/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| 25 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Adolor Corporation
Curated by ChEMBL
| Assay Description Agonistic activity at kappa opioid receptor |
Bioorg Med Chem Lett 15: 5114-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.094 BindingDB Entry DOI: 10.7270/Q23F4P6H |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50174965
(5-Methylsulfamoyl-2,3-dihydro-benzofuran-2-carboxy...)Show SMILES CNS(=O)(=O)c1ccc2OC(Cc2c1)C(=O)N(C)[C@H](CN1CC[C@H](O)C1)c1ccccc1 Show InChI InChI=1S/C23H29N3O5S/c1-24-32(29,30)19-8-9-21-17(12-19)13-22(31-21)23(28)25(2)20(16-6-4-3-5-7-16)15-26-11-10-18(27)14-26/h3-9,12,18,20,22,24,27H,10-11,13-15H2,1-2H3/t18-,20+,22?/m0/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Adolor Corporation
Curated by ChEMBL
| Assay Description Agonistic activity at mu opioid receptor |
Bioorg Med Chem Lett 15: 5114-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.094 BindingDB Entry DOI: 10.7270/Q23F4P6H |
More data for this Ligand-Target Pair | |
Cytochrome P450 2D6
(Homo sapiens (Human)) | BDBM50174965
(5-Methylsulfamoyl-2,3-dihydro-benzofuran-2-carboxy...)Show SMILES CNS(=O)(=O)c1ccc2OC(Cc2c1)C(=O)N(C)[C@H](CN1CC[C@H](O)C1)c1ccccc1 Show InChI InChI=1S/C23H29N3O5S/c1-24-32(29,30)19-8-9-21-17(12-19)13-22(31-21)23(28)25(2)20(16-6-4-3-5-7-16)15-26-11-10-18(27)14-26/h3-9,12,18,20,22,24,27H,10-11,13-15H2,1-2H3/t18-,20+,22?/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
Adolor Corporation
Curated by ChEMBL
| Assay Description Inhibitory activity against CYP2D6 |
Bioorg Med Chem Lett 15: 5114-9 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.094 BindingDB Entry DOI: 10.7270/Q23F4P6H |
More data for this Ligand-Target Pair | |