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ChEMBL ligand: CHEMBL1093059 (Bardoxolona, Bardoxolone, CDDO, RTA 401, RTA-401, RTA401) |
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DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
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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 (2017) |
kelch like ECH-associated protein 1/Kelch-like ECH-associated protein 1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2069156] [GtoPdb: 2757] [UniProtKB: Q14145] | ||||||||
ChEMBL | Binding affinity to Keap1 (unknown origin) assessed as dissociation constant incubated for 200 sec by sensor chip immobilization based surface plasmon resonance analysis | B | 4.31 | pKd | 48720 | nM | Kd | J Med Chem (2023) 66: 9184-9200 [PMID:37386884] |
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] |
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] |
ChEMBL data shown on this page come from version 34:
Zdrazil B, Felix E, Hunter F, Manners EJ, Blackshaw J, Corbett S, de Veij M, Ioannidis H, Lopez DM, Mosquera JF, Magarinos MP, Bosc N, Arcila R, Kizilören T, Gaulton A, Bento AP, Adasme MF, Monecke P, Landrum GA, Leach AR. (2024). The ChEMBL Database in 2023: a drug discovery platform spanning multiple bioactivity data types and time periods. Nucleic Acids Res., 52(D1). DOI: 10.1093/nar/gkad1004. [EPMCID:10767899] [PMID:37933841]
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]