bardoxolone [Ligand Id: 2717] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL1093059 (2-Cyano-3,12-Dioxooleana-1,9(11)-Dien-28-Oic Acid, Bardoxolone, CDDO, RTA 401, RTA-401)
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  • Inducible NOS/Nitric oxide synthase, inducible in Human [ChEMBL: CHEMBL4481] [GtoPdb: 1250] [UniProtKB: P35228]
  • Inducible NOS/Nitric oxide synthase, inducible in Mouse [ChEMBL: CHEMBL3464] [GtoPdb: 1250] [UniProtKB: P29477]
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  • Peroxisome proliferator-activated receptor-γ in Human [GtoPdb: 595] [UniProtKB: P37231]
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  • kelch like ECH-associated protein 1 in Human [GtoPdb: 2757] [UniProtKB: Q14145]
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
Ghrelin O-acyltransferase in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3588729] [UniProtKB: Q96T53]
ChEMBL Inhibition of human GOAT expressed in Sf9 cell membranes assessed as reduction in ghrelin octanoylation pre-incubated for 15 mins before substrate addition and measured after 3 hrs using octanoyl-CoA and fluorescent ghrelin peptide by HPLC analysis B 4 pIC50 >100000 nM IC50 US-20170056373-A1. Ghrelin o-acyltransferase inhibitors (null)
Inducible NOS/Nitric oxide synthase, inducible in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4481] [GtoPdb: 1250] [UniProtKB: P35228]
ChEMBL Inhibition of inducible nitric oxide synthase in activated macrophages B 9.7 pIC50 0.2 nM IC50 Bioorg Med Chem Lett (2005) 15: 2215-2219 [PMID:15837296]
Inducible NOS/Nitric oxide synthase, inducible in Mouse (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3464] [GtoPdb: 1250] [UniProtKB: P29477]
ChEMBL Inhibition of iNOS in LPS-stimulated mouse RAW264.7 cells assessed as inhibition of nitric oxide production after 48 hrs by Griess assay B 7.64 pIC50 23 nM IC50 J Med Chem (2015) 58: 4738-4748 [PMID:25965897]
Peroxisome proliferator-activated receptor-γ in Human [GtoPdb: 595] [UniProtKB: P37231]
GtoPdb - - 8 pKi - - - Mol Endocrinol (2000) 14: 1550-6 [PMID:11043571]
kelch like ECH-associated protein 1 in Human [GtoPdb: 2757] [UniProtKB: Q14145]
GtoPdb Measuring inhibition of KEAP1 binding to Cul3 using an AlphaScreen bead-based proximity assay. - 7 pIC50 <100 nM IC50 PLoS ONE (2014) 9: e98896 [PMID:24896564]

ChEMBL data shown on this page come from version 32:

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]