Found 12 hits of Enzyme Inhibition Constant Data Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kJ/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50244177
(1'-[(3-methyl-1-phenyl-1H-pyrazol-4-yl)methyl]-3H-...)Show InChI InChI=1S/C23H25N3O/c1-18-20(16-26(24-18)21-8-3-2-4-9-21)15-25-13-11-23(12-14-25)22-10-6-5-7-19(22)17-27-23/h2-10,16H,11-15,17H2,1H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 740 | n/a | n/a | n/a | n/a | n/a | n/a |
Tsukuba Research Institute
Curated by ChEMBL
| Assay Description Displacement of [35S]MK499 from human ERG in HEK293 cell membrane |
Bioorg Med Chem Lett 18: 3778-82 (2008)
Article DOI: 10.1016/j.bmcl.2008.05.036 BindingDB Entry DOI: 10.7270/Q2XD11G6 |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50244177
(1'-[(3-methyl-1-phenyl-1H-pyrazol-4-yl)methyl]-3H-...)Show InChI InChI=1S/C23H25N3O/c1-18-20(16-26(24-18)21-8-3-2-4-9-21)15-25-13-11-23(12-14-25)22-10-6-5-7-19(22)17-27-23/h2-10,16H,11-15,17H2,1H3 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 3.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Tsukuba Research Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]diprenorphin from human cloned mu opioid receptor expressed in CHO cells |
Bioorg Med Chem Lett 18: 3778-82 (2008)
Article DOI: 10.1016/j.bmcl.2008.05.036 BindingDB Entry DOI: 10.7270/Q2XD11G6 |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50244275
(1'-{[3-methyl-1-(3-methylpyridin-2-yl)-1H-pyrazol-...)Show SMILES Cc1nn(cc1CN1CCC2(CC1)OCc1ccccc21)-c1ncccc1C Show InChI InChI=1S/C23H26N4O/c1-17-6-5-11-24-22(17)27-15-20(18(2)25-27)14-26-12-9-23(10-13-26)21-8-4-3-7-19(21)16-28-23/h3-8,11,15H,9-10,12-14,16H2,1-2H3 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 4.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Tsukuba Research Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]diprenorphin from human cloned mu opioid receptor expressed in CHO cells |
Bioorg Med Chem Lett 18: 3778-82 (2008)
Article DOI: 10.1016/j.bmcl.2008.05.036 BindingDB Entry DOI: 10.7270/Q2XD11G6 |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50244247
(1'-{[1-(3-chloropyridin-2-yl)-3-methyl-1H-pyrazol-...)Show SMILES Cc1nn(cc1CN1CCC2(CC1)OCc1ccccc21)-c1ncccc1Cl Show InChI InChI=1S/C22H23ClN4O/c1-16-18(14-27(25-16)21-20(23)7-4-10-24-21)13-26-11-8-22(9-12-26)19-6-3-2-5-17(19)15-28-22/h2-7,10,14H,8-9,11-13,15H2,1H3 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 7.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Tsukuba Research Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]diprenorphin from human cloned mu opioid receptor expressed in CHO cells |
Bioorg Med Chem Lett 18: 3778-82 (2008)
Article DOI: 10.1016/j.bmcl.2008.05.036 BindingDB Entry DOI: 10.7270/Q2XD11G6 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50244247
(1'-{[1-(3-chloropyridin-2-yl)-3-methyl-1H-pyrazol-...)Show SMILES Cc1nn(cc1CN1CCC2(CC1)OCc1ccccc21)-c1ncccc1Cl Show InChI InChI=1S/C22H23ClN4O/c1-16-18(14-27(25-16)21-20(23)7-4-10-24-21)13-26-11-8-22(9-12-26)19-6-3-2-5-17(19)15-28-22/h2-7,10,14H,8-9,11-13,15H2,1H3 | 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 | 7.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Tsukuba Research Institute
Curated by ChEMBL
| Assay Description Displacement of [35S]MK499 from human ERG in HEK293 cell membrane |
Bioorg Med Chem Lett 18: 3778-82 (2008)
Article DOI: 10.1016/j.bmcl.2008.05.036 BindingDB Entry DOI: 10.7270/Q2XD11G6 |
More data for this Ligand-Target Pair | |
Kappa-type opioid receptor
(Homo sapiens (Human)) | BDBM50244177
(1'-[(3-methyl-1-phenyl-1H-pyrazol-4-yl)methyl]-3H-...)Show InChI InChI=1S/C23H25N3O/c1-18-20(16-26(24-18)21-8-3-2-4-9-21)15-25-13-11-23(12-14-25)22-10-6-5-7-19(22)17-27-23/h2-10,16H,11-15,17H2,1H3 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 9.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Tsukuba Research Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]U69593 from human cloned kappa opioid receptor expressed in CHO cells |
Bioorg Med Chem Lett 18: 3778-82 (2008)
Article DOI: 10.1016/j.bmcl.2008.05.036 BindingDB Entry DOI: 10.7270/Q2XD11G6 |
More data for this Ligand-Target Pair | |
Kappa-type opioid receptor
(Homo sapiens (Human)) | BDBM50244313
(1'-{[1-(3-chloropyridin-2-yl)-1H-pyrazol-4-yl]meth...)Show SMILES Cc1nn(cc1CN1CCC2(CC1)OCc1ccccc21)-c1c(Cl)cccc1NS(C)(=O)=O Show InChI InChI=1S/C24H27ClN4O3S/c1-17-19(15-29(26-17)23-21(25)8-5-9-22(23)27-33(2,30)31)14-28-12-10-24(11-13-28)20-7-4-3-6-18(20)16-32-24/h3-9,15,27H,10-14,16H2,1-2H3 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Tsukuba Research Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]U69593 from human cloned kappa opioid receptor expressed in CHO cells |
Bioorg Med Chem Lett 18: 3778-82 (2008)
Article DOI: 10.1016/j.bmcl.2008.05.036 BindingDB Entry DOI: 10.7270/Q2XD11G6 |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50244313
(1'-{[1-(3-chloropyridin-2-yl)-1H-pyrazol-4-yl]meth...)Show SMILES Cc1nn(cc1CN1CCC2(CC1)OCc1ccccc21)-c1c(Cl)cccc1NS(C)(=O)=O Show InChI InChI=1S/C24H27ClN4O3S/c1-17-19(15-29(26-17)23-21(25)8-5-9-22(23)27-33(2,30)31)14-28-12-10-24(11-13-28)20-7-4-3-6-18(20)16-32-24/h3-9,15,27H,10-14,16H2,1-2H3 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Tsukuba Research Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]diprenorphin from human cloned mu opioid receptor expressed in CHO cells |
Bioorg Med Chem Lett 18: 3778-82 (2008)
Article DOI: 10.1016/j.bmcl.2008.05.036 BindingDB Entry DOI: 10.7270/Q2XD11G6 |
More data for this Ligand-Target Pair | |
Kappa-type opioid receptor
(Homo sapiens (Human)) | BDBM50244275
(1'-{[3-methyl-1-(3-methylpyridin-2-yl)-1H-pyrazol-...)Show SMILES Cc1nn(cc1CN1CCC2(CC1)OCc1ccccc21)-c1ncccc1C Show InChI InChI=1S/C23H26N4O/c1-17-6-5-11-24-22(17)27-15-20(18(2)25-27)14-26-12-9-23(10-13-26)21-8-4-3-7-19(21)16-28-23/h3-8,11,15H,9-10,12-14,16H2,1-2H3 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Tsukuba Research Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]U69593 from human cloned kappa opioid receptor expressed in CHO cells |
Bioorg Med Chem Lett 18: 3778-82 (2008)
Article DOI: 10.1016/j.bmcl.2008.05.036 BindingDB Entry DOI: 10.7270/Q2XD11G6 |
More data for this Ligand-Target Pair | |
Kappa-type opioid receptor
(Homo sapiens (Human)) | BDBM50244247
(1'-{[1-(3-chloropyridin-2-yl)-3-methyl-1H-pyrazol-...)Show SMILES Cc1nn(cc1CN1CCC2(CC1)OCc1ccccc21)-c1ncccc1Cl Show InChI InChI=1S/C22H23ClN4O/c1-16-18(14-27(25-16)21-20(23)7-4-10-24-21)13-26-11-8-22(9-12-26)19-6-3-2-5-17(19)15-28-22/h2-7,10,14H,8-9,11-13,15H2,1H3 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Tsukuba Research Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]U69593 from human cloned kappa opioid receptor expressed in CHO cells |
Bioorg Med Chem Lett 18: 3778-82 (2008)
Article DOI: 10.1016/j.bmcl.2008.05.036 BindingDB Entry DOI: 10.7270/Q2XD11G6 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50244275
(1'-{[3-methyl-1-(3-methylpyridin-2-yl)-1H-pyrazol-...)Show SMILES Cc1nn(cc1CN1CCC2(CC1)OCc1ccccc21)-c1ncccc1C Show InChI InChI=1S/C23H26N4O/c1-17-6-5-11-24-22(17)27-15-20(18(2)25-27)14-26-12-9-23(10-13-26)21-8-4-3-7-19(21)16-28-23/h3-8,11,15H,9-10,12-14,16H2,1-2H3 | 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 | 1.30E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Tsukuba Research Institute
Curated by ChEMBL
| Assay Description Displacement of [35S]MK499 from human ERG in HEK293 cell membrane |
Bioorg Med Chem Lett 18: 3778-82 (2008)
Article DOI: 10.1016/j.bmcl.2008.05.036 BindingDB Entry DOI: 10.7270/Q2XD11G6 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50244313
(1'-{[1-(3-chloropyridin-2-yl)-1H-pyrazol-4-yl]meth...)Show SMILES Cc1nn(cc1CN1CCC2(CC1)OCc1ccccc21)-c1c(Cl)cccc1NS(C)(=O)=O Show InChI InChI=1S/C24H27ClN4O3S/c1-17-19(15-29(26-17)23-21(25)8-5-9-22(23)27-33(2,30)31)14-28-12-10-24(11-13-28)20-7-4-3-6-18(20)16-32-24/h3-9,15,27H,10-14,16H2,1-2H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 1.70E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Tsukuba Research Institute
Curated by ChEMBL
| Assay Description Displacement of [35S]MK499 from human ERG in HEK293 cell membrane |
Bioorg Med Chem Lett 18: 3778-82 (2008)
Article DOI: 10.1016/j.bmcl.2008.05.036 BindingDB Entry DOI: 10.7270/Q2XD11G6 |
More data for this Ligand-Target Pair | |