azalanstat [Ligand Id: 8799] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL70611 (Azalanstat)
  • CYP11B1/Cytochrome P450 11B1 in Human [ChEMBL: CHEMBL1908] [GtoPdb: 1359] [UniProtKB: P15538]
  • CYP11B1 in Bovine [GtoPdb: 1359]
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  • CYP51A1 in Human [GtoPdb: 1374] [UniProtKB: Q16850]
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
CYP11B1/Cytochrome P450 11B1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1908] [GtoPdb: 1359] [UniProtKB: P15538]
ChEMBL Binding affinity for corticoid 11-beta-hydroxylase B 7.46 pKi 35 nM Ki J Med Chem (1993) 36: 2235-2237 [PMID:8340925]
CYP11B1 in Bovine [GtoPdb: 1359]
GtoPdb - - 7.46 pKi 35 nM Ki J Med Chem (1993) 36: 2235-7 [PMID:8340925]
CYP17A1/Cytochrome P450 17A1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3522] [GtoPdb: 1361] [UniProtKB: P05093]
ChEMBL Binding affinity for cholesterol 17-alpha-hydroxylase B 5.79 pKi 1625 nM Ki J Med Chem (1993) 36: 2235-2237 [PMID:8340925]
ChEMBL Binding affinity for progesterone 17-alpha,20-lyase B 6.35 pKi 447 nM Ki J Med Chem (1993) 36: 2235-2237 [PMID:8340925]
CYP19A1/Cytochrome P450 19A1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1978] [GtoPdb: 1362] [UniProtKB: P11511]
ChEMBL Binding affinity for Cytochrome P450 19A1 B 8.12 pKi 7.6 nM Ki J Med Chem (1993) 36: 2235-2237 [PMID:8340925]
GtoPdb - - 8.12 pKi 7.6 nM Ki J Med Chem (1993) 36: 2235-7 [PMID:8340925]
Haem oxygenase 1/Heme oxygenase 1 in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5035] [GtoPdb: 1441] [UniProtKB: P06762]
ChEMBL In vitro inhibitory concentration against heme oxygenase 1 from rat spleen B 5.22 pIC50 6000 nM IC50 Bioorg Med Chem Lett (2005) 15: 1457-1461 [PMID:15713406]
ChEMBL Inhibition of Sprague-Dawley rat spleen HO1 B 5.22 pIC50 6000 nM IC50 J Med Chem (2006) 49: 4437-4441 [PMID:16821802]
ChEMBL Inhibition of heme oxygenase 1 in Sprague-Dawley rat spleen microsomal fraction assessed as decrease in bilirubin formation using biliverdin reductase as substrate after 60 mins by spectrophotometric method B 5.22 pIC50 6000 nM IC50 Eur J Med Chem (2018) 158: 937-950 [PMID:30261468]
ChEMBL Inhibition of Sprague-Dawley rat spleen microsomal HO-1 assessed as bilirubin formation after 60 mins by spectrophotometric analysis B 5.26 pIC50 5500 nM IC50 Bioorg Med Chem (2013) 21: 5145-5153 [PMID:23867390]
ChEMBL Inhibition of HO-1 in Sprague-Dawley albino rat spleen microsomes assessed as reduction in bilirubin formation using hemin as substrate after 60 mins in presence of NADPH by biliverdin reductase enzyme coupled spectrophotometric assay B 5.28 pIC50 5300 nM IC50 Eur J Med Chem (2018) 148: 54-62 [PMID:29454190]
ChEMBL Inhibition of Sprague-Dawley rat spleen microsome HO1 B 5.28 pIC50 5300 nM IC50 Bioorg Med Chem (2007) 15: 3225-3234 [PMID:17339115]
ChEMBL Inhibition of Sprague-Dawley rat spleen microsome HO-1 assessed as bilirubin formation incubated for 60 mins by double-beam spectrophotometry B 5.28 pIC50 5300 nM IC50 J Med Chem (2021) 64: 13373-13393 [PMID:34472337]
Haem oxygenase 2/Heme oxygenase 2 in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3348] [GtoPdb: 1442] [UniProtKB: P23711]
ChEMBL In vitro inhibitory concentration against heme oxygenase 2 from rat brain B 4.55 pIC50 28000 nM IC50 Bioorg Med Chem Lett (2005) 15: 1457-1461 [PMID:15713406]
ChEMBL Inhibition of Sprague-Dawley rat brain HO2 B 4.55 pIC50 28000 nM IC50 J Med Chem (2006) 49: 4437-4441 [PMID:16821802]
ChEMBL Inhibition of Sprague-Dawley rat brain microsome HO2 B 4.61 pIC50 24500 nM IC50 Bioorg Med Chem (2007) 15: 3225-3234 [PMID:17339115]
ChEMBL Inhibition of Sprague-Dawley rat brain HO-2 assessed as bilirubin formation after 60 mins by spectrophotometric analysis B 4.61 pIC50 24500 nM IC50 Bioorg Med Chem (2013) 21: 5145-5153 [PMID:23867390]
ChEMBL Inhibition of HO-2 in Sprague-Dawley albino rat brain microsomes assessed as reduction in bilirubin formation using hemin as substrate after 60 mins in presence of NADPH by biliverdin reductase enzyme coupled spectrophotometric assay B 4.61 pIC50 24400 nM IC50 Eur J Med Chem (2018) 148: 54-62 [PMID:29454190]
ChEMBL Inhibition of Sprague-Dawley rat brain microsome HO-2 assessed as bilirubin formation incubated for 60 mins by double-beam spectrophotometry B 4.61 pIC50 24400 nM IC50 J Med Chem (2021) 64: 13373-13393 [PMID:34472337]
CYP51A1 in Human [GtoPdb: 1374] [UniProtKB: Q16850]
GtoPdb - - 9.1 pKi 0.79 nM Ki J Med Chem (1993) 36: 2235-7 [PMID:8340925]

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]