Found 100 hits Enz. Inhib. hit(s) with all data for entry = 50000220 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 |
Kappa-type opioid receptor
(Cavia porcellus (domestic guinea pig)) | BDBM50242686
(CHEMBL4077003)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(O)c1)N2CC(=O)C1CCCCC1 |r,@@:7,TLB:9:7:3.2:16| Show InChI InChI=1S/C21H29NO2/c23-20-8-4-7-16(13-20)17-11-18-9-10-19(12-17)22(18)14-21(24)15-5-2-1-3-6-15/h4,7-8,13,15,17-19,23H,1-3,5-6,9-12,14H2/t18-,19-/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.0100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from guinea pig kappa opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Kappa-type opioid receptor
(Cavia porcellus (domestic guinea pig)) | BDBM50242686
(CHEMBL4077003)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(O)c1)N2CC(=O)C1CCCCC1 |r,@@:7,TLB:9:7:3.2:16| Show InChI InChI=1S/C21H29NO2/c23-20-8-4-7-16(13-20)17-11-18-9-10-19(12-17)22(18)14-21(24)15-5-2-1-3-6-15/h4,7-8,13,15,17-19,23H,1-3,5-6,9-12,14H2/t18-,19-/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.0100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from guinea pig kappa opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Kappa-type opioid receptor
(Cavia porcellus (domestic guinea pig)) | BDBM50242673
(CHEMBL4092037)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(O)c1)N2CCCc1ccccc1 |r,@@:7,TLB:9:7:3.2:16| Show InChI InChI=1S/C22H27NO/c24-22-10-4-9-18(16-22)19-14-20-11-12-21(15-19)23(20)13-5-8-17-6-2-1-3-7-17/h1-4,6-7,9-10,16,19-21,24H,5,8,11-15H2/t20-,21-/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from guinea pig kappa opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50242690
(CHEMBL4071120)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(O)c1)N2CCCOc1ccccc1 |r,@@:7,TLB:9:7:16:2.3| Show InChI InChI=1S/C22H27NO2/c24-21-7-4-6-17(16-21)18-14-19-10-11-20(15-18)23(19)12-5-13-25-22-8-2-1-3-9-22/h1-4,6-9,16,18-20,24H,5,10-15H2/t19-,20-/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Inhibition of specific binding of [3H]NANM of sigma receptor in Guinea pig brain membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50242673
(CHEMBL4092037)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(O)c1)N2CCCc1ccccc1 |r,@@:7,TLB:9:7:3.2:16| Show InChI InChI=1S/C22H27NO/c24-22-10-4-9-18(16-22)19-14-20-11-12-21(15-19)23(20)13-5-8-17-6-2-1-3-7-17/h1-4,6-7,9-10,16,19-21,24H,5,8,11-15H2/t20-,21-/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from recombinant human mu opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50242686
(CHEMBL4077003)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(O)c1)N2CC(=O)C1CCCCC1 |r,@@:7,TLB:9:7:3.2:16| Show InChI InChI=1S/C21H29NO2/c23-20-8-4-7-16(13-20)17-11-18-9-10-19(12-17)22(18)14-21(24)15-5-2-1-3-6-15/h4,7-8,13,15,17-19,23H,1-3,5-6,9-12,14H2/t18-,19-/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from recombinant human mu opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50242683
(CHEMBL4084184)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(O)c1)N2Cc1ccc(cc1)C(C)(C)C |r,@@:7,TLB:9:7:3.2:16| Show InChI InChI=1S/C24H31NO/c1-24(2,3)20-9-7-17(8-10-20)16-25-21-11-12-22(25)14-19(13-21)18-5-4-6-23(26)15-18/h4-10,15,19,21-22,26H,11-14,16H2,1-3H3/t21-,22-/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 0.100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from recombinant human mu opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50242683
(CHEMBL4084184)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(O)c1)N2Cc1ccc(cc1)C(C)(C)C |r,@@:7,TLB:9:7:3.2:16| Show InChI InChI=1S/C24H31NO/c1-24(2,3)20-9-7-17(8-10-20)16-25-21-11-12-22(25)14-19(13-21)18-5-4-6-23(26)15-18/h4-10,15,19,21-22,26H,11-14,16H2,1-3H3/t21-,22-/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 0.100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from recombinant human mu opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50242684
(CHEMBL4067358)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(c1)C(N)=O)N2Cc1ccc(cc1)C(C)(C)C |r,@:7,TLB:9:7:3.2:18| Show InChI InChI=1S/C25H32N2O/c1-25(2,3)21-9-7-17(8-10-21)16-27-22-11-12-23(27)15-20(14-22)18-5-4-6-19(13-18)24(26)28/h4-10,13,20,22-23H,11-12,14-16H2,1-3H3,(H2,26,28)/t22-,23-/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from recombinant human mu opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50242686
(CHEMBL4077003)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(O)c1)N2CC(=O)C1CCCCC1 |r,@@:7,TLB:9:7:3.2:16| Show InChI InChI=1S/C21H29NO2/c23-20-8-4-7-16(13-20)17-11-18-9-10-19(12-17)22(18)14-21(24)15-5-2-1-3-6-15/h4,7-8,13,15,17-19,23H,1-3,5-6,9-12,14H2/t18-,19-/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from recombinant human mu opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50242690
(CHEMBL4071120)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(O)c1)N2CCCOc1ccccc1 |r,@@:7,TLB:9:7:16:2.3| Show InChI InChI=1S/C22H27NO2/c24-21-7-4-6-17(16-21)18-14-19-10-11-20(15-18)23(19)12-5-13-25-22-8-2-1-3-9-22/h1-4,6-9,16,18-20,24H,5,10-15H2/t19-,20-/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from recombinant human mu opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Kappa-type opioid receptor
(Cavia porcellus (domestic guinea pig)) | BDBM50242683
(CHEMBL4084184)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(O)c1)N2Cc1ccc(cc1)C(C)(C)C |r,@@:7,TLB:9:7:3.2:16| Show InChI InChI=1S/C24H31NO/c1-24(2,3)20-9-7-17(8-10-20)16-25-21-11-12-22(25)14-19(13-21)18-5-4-6-23(26)15-18/h4-10,15,19,21-22,26H,11-14,16H2,1-3H3/t21-,22-/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 0.100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from guinea pig kappa opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Kappa-type opioid receptor
(Cavia porcellus (domestic guinea pig)) | BDBM50242687
(CHEMBL4062974)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(c1)C(N)=O)N2CC(=O)C1CCCCC1 |r,@@:7,TLB:9:7:3.2:18| Show InChI InChI=1S/C22H30N2O2/c23-22(26)17-8-4-7-16(11-17)18-12-19-9-10-20(13-18)24(19)14-21(25)15-5-2-1-3-6-15/h4,7-8,11,15,18-20H,1-3,5-6,9-10,12-14H2,(H2,23,26)/t19-,20-/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 0.100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from guinea pig kappa opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Kappa-type opioid receptor
(Cavia porcellus (domestic guinea pig)) | BDBM50242687
(CHEMBL4062974)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(c1)C(N)=O)N2CC(=O)C1CCCCC1 |r,@@:7,TLB:9:7:3.2:18| Show InChI InChI=1S/C22H30N2O2/c23-22(26)17-8-4-7-16(11-17)18-12-19-9-10-20(13-18)24(19)14-21(25)15-5-2-1-3-6-15/h4,7-8,11,15,18-20H,1-3,5-6,9-10,12-14H2,(H2,23,26)/t19-,20-/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 0.100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from guinea pig kappa opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Kappa-type opioid receptor
(Cavia porcellus (domestic guinea pig)) | BDBM50242673
(CHEMBL4092037)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(O)c1)N2CCCc1ccccc1 |r,@@:7,TLB:9:7:3.2:16| Show InChI InChI=1S/C22H27NO/c24-22-10-4-9-18(16-22)19-14-20-11-12-21(15-19)23(20)13-5-8-17-6-2-1-3-7-17/h1-4,6-7,9-10,16,19-21,24H,5,8,11-15H2/t20-,21-/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from guinea pig kappa opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Kappa-type opioid receptor
(Cavia porcellus (domestic guinea pig)) | BDBM50242683
(CHEMBL4084184)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(O)c1)N2Cc1ccc(cc1)C(C)(C)C |r,@@:7,TLB:9:7:3.2:16| Show InChI InChI=1S/C24H31NO/c1-24(2,3)20-9-7-17(8-10-20)16-25-21-11-12-22(25)14-19(13-21)18-5-4-6-23(26)15-18/h4-10,15,19,21-22,26H,11-14,16H2,1-3H3/t21-,22-/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 0.100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from guinea pig kappa opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50242684
(CHEMBL4067358)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(c1)C(N)=O)N2Cc1ccc(cc1)C(C)(C)C |r,@:7,TLB:9:7:3.2:18| Show InChI InChI=1S/C25H32N2O/c1-25(2,3)21-9-7-17(8-10-21)16-27-22-11-12-23(27)15-20(14-22)18-5-4-6-19(13-18)24(26)28/h4-10,13,20,22-23H,11-12,14-16H2,1-3H3,(H2,26,28)/t22-,23-/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Inhibition of specific binding of [125I]PIPAG to sigma receptor in Guinea pig brain membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50242673
(CHEMBL4092037)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(O)c1)N2CCCc1ccccc1 |r,@@:7,TLB:9:7:3.2:16| Show InChI InChI=1S/C22H27NO/c24-22-10-4-9-18(16-22)19-14-20-11-12-21(15-19)23(20)13-5-8-17-6-2-1-3-7-17/h1-4,6-7,9-10,16,19-21,24H,5,8,11-15H2/t20-,21-/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from recombinant human mu opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Kappa-type opioid receptor
(Cavia porcellus (domestic guinea pig)) | BDBM50242684
(CHEMBL4067358)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(c1)C(N)=O)N2Cc1ccc(cc1)C(C)(C)C |r,@:7,TLB:9:7:3.2:18| Show InChI InChI=1S/C25H32N2O/c1-25(2,3)21-9-7-17(8-10-21)16-27-22-11-12-23(27)15-20(14-22)18-5-4-6-19(13-18)24(26)28/h4-10,13,20,22-23H,11-12,14-16H2,1-3H3,(H2,26,28)/t22-,23-/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from guinea pig kappa opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Kappa-type opioid receptor
(Cavia porcellus (domestic guinea pig)) | BDBM50242684
(CHEMBL4067358)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(c1)C(N)=O)N2Cc1ccc(cc1)C(C)(C)C |r,@:7,TLB:9:7:3.2:18| Show InChI InChI=1S/C25H32N2O/c1-25(2,3)21-9-7-17(8-10-21)16-27-22-11-12-23(27)15-20(14-22)18-5-4-6-19(13-18)24(26)28/h4-10,13,20,22-23H,11-12,14-16H2,1-3H3,(H2,26,28)/t22-,23-/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from guinea pig kappa opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50242676
(CHEMBL4059786)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(c1)C(N)=O)N2CCCc1ccccc1 |r,@:7,TLB:9:7:3.2:18| Show InChI InChI=1S/C23H28N2O/c24-23(26)19-10-4-9-18(14-19)20-15-21-11-12-22(16-20)25(21)13-5-8-17-6-2-1-3-7-17/h1-4,6-7,9-10,14,20-22H,5,8,11-13,15-16H2,(H2,24,26)/t21-,22-/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.126 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from recombinant human mu opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50242676
(CHEMBL4059786)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(c1)C(N)=O)N2CCCc1ccccc1 |r,@:7,TLB:9:7:3.2:18| Show InChI InChI=1S/C23H28N2O/c24-23(26)19-10-4-9-18(14-19)20-15-21-11-12-22(16-20)25(21)13-5-8-17-6-2-1-3-7-17/h1-4,6-7,9-10,14,20-22H,5,8,11-13,15-16H2,(H2,24,26)/t21-,22-/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.126 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from recombinant human mu opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50242687
(CHEMBL4062974)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(c1)C(N)=O)N2CC(=O)C1CCCCC1 |r,@@:7,TLB:9:7:3.2:18| Show InChI InChI=1S/C22H30N2O2/c23-22(26)17-8-4-7-16(11-17)18-12-19-9-10-20(13-18)24(19)14-21(25)15-5-2-1-3-6-15/h4,7-8,11,15,18-20H,1-3,5-6,9-10,12-14H2,(H2,23,26)/t19-,20-/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 0.158 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Inhibition of specific binding of [3H]DTG to sigma binding site in Guinea pig brain membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50242687
(CHEMBL4062974)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(c1)C(N)=O)N2CC(=O)C1CCCCC1 |r,@@:7,TLB:9:7:3.2:18| Show InChI InChI=1S/C22H30N2O2/c23-22(26)17-8-4-7-16(11-17)18-12-19-9-10-20(13-18)24(19)14-21(25)15-5-2-1-3-6-15/h4,7-8,11,15,18-20H,1-3,5-6,9-10,12-14H2,(H2,23,26)/t19-,20-/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 0.158 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from recombinant human mu opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Kappa-type opioid receptor
(Cavia porcellus (domestic guinea pig)) | BDBM50242676
(CHEMBL4059786)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(c1)C(N)=O)N2CCCc1ccccc1 |r,@:7,TLB:9:7:3.2:18| Show InChI InChI=1S/C23H28N2O/c24-23(26)19-10-4-9-18(14-19)20-15-21-11-12-22(16-20)25(21)13-5-8-17-6-2-1-3-7-17/h1-4,6-7,9-10,14,20-22H,5,8,11-13,15-16H2,(H2,24,26)/t21-,22-/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.158 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from guinea pig kappa opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50242672
(CHEMBL4071225)Show SMILES Oc1cccc(c1)C1CC2CCC(C1)N2CCCc1ccccc1 |TLB:5:7:10.11:14| Show InChI InChI=1S/C22H27NO/c24-22-10-4-9-18(16-22)19-14-20-11-12-21(15-19)23(20)13-5-8-17-6-2-1-3-7-17/h1-4,6-7,9-10,16,19-21,24H,5,8,11-15H2 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.158 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from recombinant human mu opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50242678
(CHEMBL4062483)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(c1)C(N)=O)N2CCCOc1ccccc1 |r,@@:7,TLB:9:7:18:2.3| Show InChI InChI=1S/C23H28N2O2/c24-23(26)18-7-4-6-17(14-18)19-15-20-10-11-21(16-19)25(20)12-5-13-27-22-8-2-1-3-9-22/h1-4,6-9,14,19-21H,5,10-13,15-16H2,(H2,24,26)/t20-,21-/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.200 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from recombinant human mu opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50242678
(CHEMBL4062483)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(c1)C(N)=O)N2CCCOc1ccccc1 |r,@@:7,TLB:9:7:18:2.3| Show InChI InChI=1S/C23H28N2O2/c24-23(26)18-7-4-6-17(14-18)19-15-20-10-11-21(16-19)25(20)12-5-13-27-22-8-2-1-3-9-22/h1-4,6-9,14,19-21H,5,10-13,15-16H2,(H2,24,26)/t20-,21-/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.200 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from recombinant human mu opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50242688
(CHEMBL4065743)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(O)c1)N2CC(O)Cc1ccccc1 |r,@:7,TLB:9:7:3.2:16| Show InChI InChI=1S/C22H27NO2/c24-21-8-4-7-17(14-21)18-12-19-9-10-20(13-18)23(19)15-22(25)11-16-5-2-1-3-6-16/h1-8,14,18-20,22,24-25H,9-13,15H2/t19-,20-,22?/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.251 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from recombinant human mu opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50242689
(CHEMBL4069933)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(c1)C(N)=O)N2CC(O)Cc1ccccc1 |r,@:7,TLB:9:7:3.2:18| Show InChI InChI=1S/C23H28N2O2/c24-23(27)18-8-4-7-17(12-18)19-13-20-9-10-21(14-19)25(20)15-22(26)11-16-5-2-1-3-6-16/h1-8,12,19-22,26H,9-11,13-15H2,(H2,24,27)/t20-,21-,22?/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.251 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from recombinant human mu opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Kappa-type opioid receptor
(Cavia porcellus (domestic guinea pig)) | BDBM50242690
(CHEMBL4071120)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(O)c1)N2CCCOc1ccccc1 |r,@@:7,TLB:9:7:16:2.3| Show InChI InChI=1S/C22H27NO2/c24-21-7-4-6-17(16-21)18-14-19-10-11-20(15-18)23(19)12-5-13-25-22-8-2-1-3-9-22/h1-4,6-9,16,18-20,24H,5,10-15H2/t19-,20-/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.251 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from guinea pig kappa opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50242679
(CHEMBL4082678)Show SMILES [H][C@@]12CC[C@]([H])(C[C@H](C1)c1cccc(O)c1)N2CCCCCCC |r,TLB:9:7:16:2.3| Show InChI InChI=1S/C20H31NO/c1-2-3-4-5-6-12-21-18-10-11-19(21)14-17(13-18)16-8-7-9-20(22)15-16/h7-9,15,17-19,22H,2-6,10-14H2,1H3/t18-,19-/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.251 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from recombinant human mu opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Kappa-type opioid receptor
(Cavia porcellus (domestic guinea pig)) | BDBM50242679
(CHEMBL4082678)Show SMILES [H][C@@]12CC[C@]([H])(C[C@H](C1)c1cccc(O)c1)N2CCCCCCC |r,TLB:9:7:16:2.3| Show InChI InChI=1S/C20H31NO/c1-2-3-4-5-6-12-21-18-10-11-19(21)14-17(13-18)16-8-7-9-20(22)15-16/h7-9,15,17-19,22H,2-6,10-14H2,1H3/t18-,19-/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.251 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from guinea pig kappa opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Kappa-type opioid receptor
(Cavia porcellus (domestic guinea pig)) | BDBM50242679
(CHEMBL4082678)Show SMILES [H][C@@]12CC[C@]([H])(C[C@H](C1)c1cccc(O)c1)N2CCCCCCC |r,TLB:9:7:16:2.3| Show InChI InChI=1S/C20H31NO/c1-2-3-4-5-6-12-21-18-10-11-19(21)14-17(13-18)16-8-7-9-20(22)15-16/h7-9,15,17-19,22H,2-6,10-14H2,1H3/t18-,19-/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.251 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from guinea pig kappa opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50242679
(CHEMBL4082678)Show SMILES [H][C@@]12CC[C@]([H])(C[C@H](C1)c1cccc(O)c1)N2CCCCCCC |r,TLB:9:7:16:2.3| Show InChI InChI=1S/C20H31NO/c1-2-3-4-5-6-12-21-18-10-11-19(21)14-17(13-18)16-8-7-9-20(22)15-16/h7-9,15,17-19,22H,2-6,10-14H2,1H3/t18-,19-/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.251 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from recombinant human mu opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Kappa-type opioid receptor
(Cavia porcellus (domestic guinea pig)) | BDBM50242690
(CHEMBL4071120)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(O)c1)N2CCCOc1ccccc1 |r,@@:7,TLB:9:7:16:2.3| Show InChI InChI=1S/C22H27NO2/c24-21-7-4-6-17(16-21)18-14-19-10-11-20(15-18)23(19)12-5-13-25-22-8-2-1-3-9-22/h1-4,6-9,16,18-20,24H,5,10-15H2/t19-,20-/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.251 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from guinea pig kappa opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50242689
(CHEMBL4069933)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(c1)C(N)=O)N2CC(O)Cc1ccccc1 |r,@:7,TLB:9:7:3.2:18| Show InChI InChI=1S/C23H28N2O2/c24-23(27)18-8-4-7-17(12-18)19-13-20-9-10-21(14-19)25(20)15-22(26)11-16-5-2-1-3-6-16/h1-8,12,19-22,26H,9-11,13-15H2,(H2,24,27)/t20-,21-,22?/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.251 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from recombinant human mu opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50242688
(CHEMBL4065743)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(O)c1)N2CC(O)Cc1ccccc1 |r,@:7,TLB:9:7:3.2:16| Show InChI InChI=1S/C22H27NO2/c24-21-8-4-7-17(14-21)18-12-19-9-10-20(13-18)23(19)15-22(25)11-16-5-2-1-3-6-16/h1-8,14,18-20,22,24-25H,9-13,15H2/t19-,20-,22?/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.251 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from recombinant human mu opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Kappa-type opioid receptor
(Cavia porcellus (domestic guinea pig)) | BDBM50242689
(CHEMBL4069933)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(c1)C(N)=O)N2CC(O)Cc1ccccc1 |r,@:7,TLB:9:7:3.2:18| Show InChI InChI=1S/C23H28N2O2/c24-23(27)18-8-4-7-17(12-18)19-13-20-9-10-21(14-19)25(20)15-22(26)11-16-5-2-1-3-6-16/h1-8,12,19-22,26H,9-11,13-15H2,(H2,24,27)/t20-,21-,22?/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.316 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from guinea pig kappa opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50088381
(ADL 8-2698 | Alvimopan | Entereg)Show SMILES C[C@H]1CN(C[C@H](Cc2ccccc2)C(=O)NCC(O)=O)CC[C@@]1(C)c1cccc(O)c1 Show InChI InChI=1S/C25H32N2O4/c1-18-16-27(12-11-25(18,2)21-9-6-10-22(28)14-21)17-20(24(31)26-15-23(29)30)13-19-7-4-3-5-8-19/h3-10,14,18,20,28H,11-13,15-17H2,1-2H3,(H,26,31)(H,29,30)/t18-,20-,25+/m0/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
DrugBank MCE PC cid PC sid PDB UniChem
Similars
| DrugBank PDB Article PubMed
| 0.316 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from recombinant human mu opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Kappa-type opioid receptor
(Cavia porcellus (domestic guinea pig)) | BDBM50242689
(CHEMBL4069933)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(c1)C(N)=O)N2CC(O)Cc1ccccc1 |r,@:7,TLB:9:7:3.2:18| Show InChI InChI=1S/C23H28N2O2/c24-23(27)18-8-4-7-17(12-18)19-13-20-9-10-21(14-19)25(20)15-22(26)11-16-5-2-1-3-6-16/h1-8,12,19-22,26H,9-11,13-15H2,(H2,24,27)/t20-,21-,22?/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.316 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from guinea pig kappa opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50242680
(CHEMBL4060795)Show SMILES [H][C@@]12CC[C@]([H])(C[C@H](C1)c1cccc(c1)C(N)=O)N2CCCCCCC |r,TLB:9:7:18:3.2| Show InChI InChI=1S/C21H32N2O/c1-2-3-4-5-6-12-23-19-10-11-20(23)15-18(14-19)16-8-7-9-17(13-16)21(22)24/h7-9,13,18-20H,2-6,10-12,14-15H2,1H3,(H2,22,24)/t19-,20-/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.398 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from recombinant human mu opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50242680
(CHEMBL4060795)Show SMILES [H][C@@]12CC[C@]([H])(C[C@H](C1)c1cccc(c1)C(N)=O)N2CCCCCCC |r,TLB:9:7:18:3.2| Show InChI InChI=1S/C21H32N2O/c1-2-3-4-5-6-12-23-19-10-11-20(23)15-18(14-19)16-8-7-9-17(13-16)21(22)24/h7-9,13,18-20H,2-6,10-12,14-15H2,1H3,(H2,22,24)/t19-,20-/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.398 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from recombinant human mu opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Kappa-type opioid receptor
(Cavia porcellus (domestic guinea pig)) | BDBM50242680
(CHEMBL4060795)Show SMILES [H][C@@]12CC[C@]([H])(C[C@H](C1)c1cccc(c1)C(N)=O)N2CCCCCCC |r,TLB:9:7:18:3.2| Show InChI InChI=1S/C21H32N2O/c1-2-3-4-5-6-12-23-19-10-11-20(23)15-18(14-19)16-8-7-9-17(13-16)21(22)24/h7-9,13,18-20H,2-6,10-12,14-15H2,1H3,(H2,22,24)/t19-,20-/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.398 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from guinea pig kappa opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Delta-type opioid receptor
(Homo sapiens (Human)) | BDBM50242686
(CHEMBL4077003)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(O)c1)N2CC(=O)C1CCCCC1 |r,@@:7,TLB:9:7:3.2:16| Show InChI InChI=1S/C21H29NO2/c23-20-8-4-7-16(13-20)17-11-18-9-10-19(12-17)22(18)14-21(24)15-5-2-1-3-6-15/h4,7-8,13,15,17-19,23H,1-3,5-6,9-12,14H2/t18-,19-/m1/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.501 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from recombinant human delta opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Delta-type opioid receptor
(Homo sapiens (Human)) | BDBM50242683
(CHEMBL4084184)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(O)c1)N2Cc1ccc(cc1)C(C)(C)C |r,@@:7,TLB:9:7:3.2:16| Show InChI InChI=1S/C24H31NO/c1-24(2,3)20-9-7-17(8-10-20)16-25-21-11-12-22(25)14-19(13-21)18-5-4-6-23(26)15-18/h4-10,15,19,21-22,26H,11-14,16H2,1-3H3/t21-,22-/m1/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 0.501 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from recombinant human delta opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Delta-type opioid receptor
(Homo sapiens (Human)) | BDBM50242686
(CHEMBL4077003)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(O)c1)N2CC(=O)C1CCCCC1 |r,@@:7,TLB:9:7:3.2:16| Show InChI InChI=1S/C21H29NO2/c23-20-8-4-7-16(13-20)17-11-18-9-10-19(12-17)22(18)14-21(24)15-5-2-1-3-6-15/h4,7-8,13,15,17-19,23H,1-3,5-6,9-12,14H2/t18-,19-/m1/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.501 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from recombinant human delta opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Delta-type opioid receptor
(Homo sapiens (Human)) | BDBM50242683
(CHEMBL4084184)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(O)c1)N2Cc1ccc(cc1)C(C)(C)C |r,@@:7,TLB:9:7:3.2:16| Show InChI InChI=1S/C24H31NO/c1-24(2,3)20-9-7-17(8-10-20)16-25-21-11-12-22(25)14-19(13-21)18-5-4-6-23(26)15-18/h4-10,15,19,21-22,26H,11-14,16H2,1-3H3/t21-,22-/m1/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 0.501 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from recombinant human delta opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Kappa-type opioid receptor
(Cavia porcellus (domestic guinea pig)) | BDBM50242677
(CHEMBL4088609)Show SMILES [H][C@@]12CC[C@]([H])(C[C@H](C1)c1cccc(O)c1)N2CCCCN1C(=O)c2ccccc2C1=O |r,TLB:9:7:16:3.2| Show InChI InChI=1S/C25H28N2O3/c28-21-7-5-6-17(16-21)18-14-19-10-11-20(15-18)26(19)12-3-4-13-27-24(29)22-8-1-2-9-23(22)25(27)30/h1-2,5-9,16,18-20,28H,3-4,10-15H2/t19-,20-/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.794 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from guinea pig kappa opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |
Delta-type opioid receptor
(Homo sapiens (Human)) | BDBM50242673
(CHEMBL4092037)Show SMILES [H][C@@]12CC[C@]([H])(CC(C1)c1cccc(O)c1)N2CCCc1ccccc1 |r,@@:7,TLB:9:7:3.2:16| Show InChI InChI=1S/C22H27NO/c24-22-10-4-9-18(16-22)19-14-20-11-12-21(15-19)23(20)13-5-8-17-6-2-1-3-7-17/h1-4,6-7,9-10,16,19-21,24H,5,8,11-15H2/t20-,21-/m1/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.794 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Theravance Biopharma US, Inc
Curated by ChEMBL
| Assay Description Displacement of [3H]DPN from recombinant human delta opioid receptor expressed in CHOK1 cell membranes |
Bioorg Med Chem Lett 27: 2926-2930 (2017)
Article DOI: 10.1016/j.bmcl.2017.04.092 BindingDB Entry DOI: 10.7270/Q2WD430K |
More data for this Ligand-Target Pair | |