ICI-199441 [Ligand Id: 11691] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL38576 (ICI-199441)
  • δ receptor/Delta opioid receptor in Human [ChEMBL: CHEMBL236] [GtoPdb: 317] [UniProtKB: P41143]
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  • κ receptor/Kappa opioid receptor in Human [ChEMBL: CHEMBL237] [GtoPdb: 318] [UniProtKB: P41145]
  • κ receptor/Kappa opioid receptor in Mouse [ChEMBL: CHEMBL4329] [GtoPdb: 318] [UniProtKB: P33534]
  • Kappa opioid receptor in Guinea pig [ChEMBL: CHEMBL3952] [UniProtKB: P41144]
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  • UT receptor/Urotensin II receptor in Human [ChEMBL: CHEMBL3764] [GtoPdb: 365] [UniProtKB: Q9UKP6]
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
δ receptor/Delta opioid receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL236] [GtoPdb: 317] [UniProtKB: P41143]
ChEMBL Inhibitory constant against human Opioid receptor delta 1 using [3H]diprenorphine as radio ligand B 7.62 pKi 24 nM Ki Bioorg Med Chem Lett (2005) 15: 2647-2652 [PMID:15863335]
ChEMBL Displacement of [3H]diprenorphine from human delta opioid receptor expressed in CHO-K1 cells B 7.62 pKi 24 nM Ki Bioorg Med Chem Lett (2008) 18: 3667-3671 [PMID:18487043]
ChEMBL Tested for inhibitory concentration against [3H]DPDPE binding at sites of delta-opioid receptor in guinea pig brain membrane B 6.22 pIC50 600 nM IC50 J Med Chem (1994) 37: 2856-2864 [PMID:8071934]
κ receptor/Kappa opioid receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL237] [GtoPdb: 318] [UniProtKB: P41145]
ChEMBL In vitro binding affinity towards Opioid receptor kappa 1 by displacement of bound [3H]U-69593 B 10.27 pKi 0.05 nM Ki Bioorg Med Chem Lett (2000) 10: 2567-2570 [PMID:11086731]
ChEMBL Displacement of [3H]diprenorphine from human kappa opioid receptor expressed in CHO-K1 cells B 10.36 pKi 0.04 nM Ki Bioorg Med Chem Lett (2008) 18: 3667-3671 [PMID:18487043]
ChEMBL In vitro binding affinity for human kappa opioid receptor was determined by using [3H]diprenorphine as radioligand B 10.37 pKi 0.04 nM Ki Bioorg Med Chem Lett (2005) 15: 1279-1282 [PMID:15713370]
ChEMBL Inhibitory constant against human Opioid receptor kappa using [3H]diprenorphine as radio ligand B 10.4 pKi 0.04 nM Ki Bioorg Med Chem Lett (2005) 15: 2647-2652 [PMID:15863335]
GtoPdb Displacement of [3H]diprenorphine from human κ opioid receptor - 10.4 pKi 0.04 nM Ki Bioorg Med Chem Lett (2005) 15: 1279-82 [PMID:15713370]
ChEMBL Agonist activity at kappa opioid receptor F 9.4 pEC50 0.4 nM EC50 Bioorg Med Chem Lett (2008) 18: 3716-3719 [PMID:18524591]
ChEMBL Agonist activity assessed by ability to stimulate [35S]GTP gammaS binding to opioid receptor kappa in human membranes F 9.52 pEC50 0.3 nM EC50 Bioorg Med Chem Lett (2005) 15: 2647-2652 [PMID:15863335]
ChEMBL Agonist activity at human kappa opioid receptor transfected in CHO cells by [35S]GTP-gamma-S binding assay F 9.52 pEC50 0.3 nM EC50 Bioorg Med Chem Lett (2008) 18: 3667-3671 [PMID:18487043]
κ receptor/Kappa opioid receptor in Mouse (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4329] [GtoPdb: 318] [UniProtKB: P33534]
ChEMBL Inhibitory activity against Opioid receptor kappa 1 in electrically stimulated mouse vas deferens (MVD) preparation. B 8.6 pIC50 2.5 nM IC50 J Med Chem (1996) 39: 1729-1735 [PMID:8648612]
Kappa opioid receptor in Guinea pig (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3952] [UniProtKB: P41144]
ChEMBL Binding affinity against opioid receptor kappa, in guinea pig brain membrane, using [3H]bremazocine as the radioligand. B 8.16 pIC50 6.9 nM IC50 J Med Chem (1991) 34: 3149-3158 [PMID:1659636]
ChEMBL Compound was evaluated for the Opioid receptor kappa 1 affinity using guinea pig brain membranes. B 8.16 pIC50 6.9 nM IC50 J Med Chem (1991) 34: 181-189 [PMID:1846918]
ChEMBL Tested for inhibitory concentration against [3H]U-69593 binding at sites of kappa-opioid receptor in guinea pig brain membrane B 8.82 pIC50 1.5 nM IC50 J Med Chem (1994) 37: 2856-2864 [PMID:8071934]
ChEMBL Inhibitory activity against Opioid receptor kappa 1 in electrically stimulated guinea pig longitudinal ileal muscle (GPI) preparation. B 9.57 pIC50 0.27 nM IC50 J Med Chem (1996) 39: 1729-1735 [PMID:8648612]
μ receptor/Mu opioid receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL233] [GtoPdb: 319] [UniProtKB: P35372]
ChEMBL Inhibitory constant against human Opioid receptor mu 1 using [3H]diprenorphine as radio ligand B 7.28 pKi 53 nM Ki Bioorg Med Chem Lett (2005) 15: 2647-2652 [PMID:15863335]
ChEMBL Displacement of [3H]diprenorphine from human mu opioid receptor expressed in CHO-K1 cells B 7.28 pKi 53 nM Ki Bioorg Med Chem Lett (2008) 18: 3667-3671 [PMID:18487043]
GtoPdb Displacement of [3H]diprenorphine from human μ opioid receptor expressed in CHO-K1 cells - 7.28 pKi 53 nM Ki Bioorg Med Chem Lett (2008) 18: 3667-71 [PMID:18487043]
Mu opioid receptor in Guinea pig (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4354] [UniProtKB: P97266]
ChEMBL Tested for inhibitory concentration against [3H]DAMGO binding at sites of mu-opioid receptor in guinea pig brain membrane B 6.82 pIC50 150 nM IC50 J Med Chem (1994) 37: 2856-2864 [PMID:8071934]
UT receptor/Urotensin II receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3764] [GtoPdb: 365] [UniProtKB: Q9UKP6]
ChEMBL Binding affinity to human urotensin-2 receptor B 5.4 pKi 4000 nM Ki Bioorg Med Chem Lett (2008) 18: 3716-3719 [PMID:18524591]

ChEMBL data shown on this page come from version 33:

Mendez D, Gaulton A, Bento AP, Chambers J, De Veij M, Félix E, Magariños MP, Mosquera JF, Mutowo P, Nowotka M, Gordillo-Marañón M, Hunter F, Junco L, Mugumbate G, Rodriguez-Lopez M, Atkinson F, Bosc N, Radoux CJ, Segura-Cabrera A, Hersey A, Leach AR. (2019) 'ChEMBL: towards direct deposition of bioassay data' Nucleic Acids Res., 47(D1). DOI: 10.1093/nar/gky1075. [EPMCID:30398643]
Davies M, Nowotka M, Papadatos G, Dedman N, Gaulton A, Atkinson F, Bellis L, Overington JP. (2015) 'ChEMBL web services: streamlining access to drug discovery data and utilities.' Nucleic Acids Res., 43(W1). DOI: 10.1093/nar/gkv352. [EPMCID:25883136]