rivanicline [Ligand Id: 3994] activity data from GtoPdb and ChEMBL
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| ChEMBL ligand: CHEMBL132966 ((e)-metanicotine, Rivanicline, TC-2403, Trans-metanicotine) |
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| DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
|---|---|---|---|---|---|---|---|---|
| nicotinic acetylcholine receptor β4 subunit/nicotinic acetylcholine receptor α3 subunit/Neuronal acetylcholine receptor; alpha3/beta4 in Human (target type: PROTEIN COMPLEX) [ChEMBL: CHEMBL1907594] [GtoPdb: 474, 464] [UniProtKB: P30926, P32297] | ||||||||
| ChEMBL | Displacement of [3H]epibatidine from human alpha3beta4 nAChR expressed in human SH-SY5Y cells | B | 5.27 | pKi | 5400 | nM | Ki | J Med Chem (2012) 55: 9929-9945 [PMID:23025891] |
| ChEMBL | Compound was evaluated for functional potencies and efficacies at human Nicotinic acetylcholine receptor subtype IMR-32 (ganglionic) | B | 4.34 | pEC50 | 46000 | nM | EC50 | J Med Chem (1997) 40: 4169-4194 [PMID:9435889] |
| nicotinic acetylcholine receptor β2 subunit/nicotinic acetylcholine receptor α4 subunit/Neuronal acetylcholine receptor; alpha4/beta2 in Human (target type: PROTEIN COMPLEX) [ChEMBL: CHEMBL1907589] [GtoPdb: 472, 465] [UniProtKB: P17787, P43681] | ||||||||
| ChEMBL | Displacement of [3H]nicotine from human alpha4beta2 nAChR expressed in human SH-EP1 cells | B | 7.59 | pKi | 26 | nM | Ki | J Med Chem (2012) 55: 9929-9945 [PMID:23025891] |
| GtoPdb | Binding affinity for the α4β2 nicotinic acetylcholine receptor. | - | 7.6 | pKi | ~25 | nM | Ki | Bioorg Med Chem Lett (2004) 14: 523-6 [PMID:14698195] |
| ChEMBL | Binding affinity towards nicotinic acetylcholine receptor alpha4-beta2 | B | 7.6 | pKi | 25 | nM | Ki | Bioorg Med Chem Lett (2004) 14: 523-526 [PMID:14698195] |
| ChEMBL | Compound was evaluated for functional potencies and efficacies at human Nicotinic acetylcholine receptor alpha4-beta2 | B | 5.37 | pEC50 | 4300 | nM | EC50 | J Med Chem (1997) 40: 4169-4194 [PMID:9435889] |
| nicotinic acetylcholine receptor α4 subunit/nicotinic acetylcholine receptor β2 subunit/Neuronal acetylcholine receptor; alpha4/beta2 in Rat (target type: PROTEIN COMPLEX) [ChEMBL: CHEMBL1907596] [GtoPdb: 465, 472] [UniProtKB: P09483, P12390] | ||||||||
| ChEMBL | Affinity for Nicotinic acetylcholine receptor alpha4-beta2 in rat brain | B | 7.59 | pKi | 26 | nM | Ki | J Med Chem (1997) 40: 4169-4194 [PMID:9435889] |
| ChEMBL | Displacement of [3H]L-nicotine from alpha-4-beta-2 nAChR in rat cerebral cortex | B | 7.59 | pKi | 26 | nM | Ki | Bioorg Med Chem Lett (2008) 18: 188-193 [PMID:18006307] |
| GtoPdb | - | - | 7.59 | pKi | 26 | nM | Ki | J Pharmacol Exp Ther (1996) 279: 1413-21 [PMID:8968366] |
| ChEMBL | Compound was evaluated for functional potencies and efficacies at rat Nicotinic acetylcholine receptor alpha4-beta2 | B | 6.14 | pEC50 | 730 | nM | EC50 | J Med Chem (1997) 40: 4169-4194 [PMID:9435889] |
| nicotinic acetylcholine receptor α7 subunit/Neuronal acetylcholine receptor protein alpha-7 subunit in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2492] [GtoPdb: 468] [UniProtKB: P36544] | ||||||||
| ChEMBL | Displacement of [3H]epibatidine from human alpha7 nAChR expressed in human HEK/RIC3 cells | B | 5.1 | pKi | 8000 | nM | Ki | J Med Chem (2012) 55: 9929-9945 [PMID:23025891] |
| nicotinic acetylcholine receptor α7 subunit/Neuronal acetylcholine receptor protein alpha-7 subunit in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4980] [GtoPdb: 468] [UniProtKB: Q05941] | ||||||||
| ChEMBL | Affinity for Nicotinic acetylcholine receptor alpha7 | B | 4.44 | pKi | 36000 | nM | Ki | J Med Chem (1997) 40: 4169-4194 [PMID:9435889] |
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]
