SB-674042 [Ligand Id: 9136] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL2110363 (SB-674042)
  • OX1 receptor/Orexin receptor 1 in Human [ChEMBL: CHEMBL5113] [GtoPdb: 321] [UniProtKB: O43613]
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  • OX2 receptor/Orexin receptor 2 in Human [ChEMBL: CHEMBL4792] [GtoPdb: 322] [UniProtKB: O43614]
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
OX1 receptor/Orexin receptor 1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5113] [GtoPdb: 321] [UniProtKB: O43613]
ChEMBL Binding affinity to OX1 receptor B 8.29 pKd 5.13 nM Kd J Med Chem (2009) 52: 891-903 [PMID:19199652]
ChEMBL Displacement of [3H]-SB67404 from human orexin 1 receptor expressed in CHO cells incubated for 2 hrs by whole cell radioligand binding assay B 8.41 pKi 3.89 nM Ki J Med Chem (2020) 63: 11045-11053 [PMID:32977721]
ChEMBL Binding affinity to orexin receptor 1 (unknown origin) B 8.96 pKi 1.1 nM Ki Bioorg Med Chem Lett (2013) 23: 4761-4769 [PMID:23891187]
GtoPdb - - 9.3 pKi 0.79 nM Ki Br J Pharmacol (2004) 141: 340-6 [PMID:14691055];
Mol Pharmacol (2009) 76: 618-31 [PMID:19542319]
OX2 receptor/Orexin receptor 2 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4792] [GtoPdb: 322] [UniProtKB: O43614]
GtoPdb - - 6.48 pKi - - - Br J Pharmacol (2009) 156: 1326-41 [PMID:19751316]
ChEMBL Binding affinity to orexin receptor 2 (unknown origin) B 6.89 pKi 129 nM Ki Bioorg Med Chem Lett (2013) 23: 4761-4769 [PMID:23891187]
GtoPdb - - 6.89 pKi 129 nM Ki Br J Pharmacol (2004) 141: 340-6 [PMID:14691055]

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]