valproic acid [Ligand Id: 7009] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL109 (44089, Convulex, Depakene, Depakote, NSC-93819, Pentanoic acid, 2-propyl, Stavzor, Valproate, Valproic acid, Valproic acid extended release)
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  • Aldose reductase in Bovine [ChEMBL: CHEMBL3081] [UniProtKB: P16116]
  • aldo-keto reductase family 1 member B/Aldose reductase in Rat [ChEMBL: CHEMBL2622] [GtoPdb: 2768] [UniProtKB: P07943]
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  • histone deacetylase 1/Histone deacetylase 1 in Human [ChEMBL: CHEMBL325] [GtoPdb: 2658] [UniProtKB: Q13547]
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  • histone deacetylase 2/Histone deacetylase 2 in Human [ChEMBL: CHEMBL1937] [GtoPdb: 2616] [UniProtKB: Q92769]
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  • sirtuin 5/NAD-dependent protein deacylase sirtuin-5, mitochondrial in Human [ChEMBL: CHEMBL2163183] [GtoPdb: 2711] [UniProtKB: Q9NXA8]
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
Aldehyde reductase in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2246] [UniProtKB: P14550]
ChEMBL Inhibition of AK1A1 B 4.3 pIC50 50100 nM IC50 J. Med. Chem. (2010) 53: 7756-7766 [PMID:20936791]
Aldehyde reductase in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3871] [UniProtKB: P51635]
ChEMBL Inhibition of Fischer-344 rat kidney AK1A1 B 4.25 pIC50 56100 nM IC50 J. Med. Chem. (2010) 53: 7756-7766 [PMID:20936791]
ChEMBL Inhibition of rat kidney aldehyde reductase at 0.1 mM after 20 mins by spectrometric analysis B 4.3 pIC50 50100 nM IC50 Bioorg. Med. Chem. (2010) 18: 2107-2114 [PMID:20189816]
Aldose reductase in Bovine (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3081] [UniProtKB: P16116]
ChEMBL Inhibition of ALR1 in calf kidney using sodium D-glucoronate as substrate treated with compound for 10 mins prior to substrate addition by UV spectrophotometer analysis B 4.24 pIC50 57400 nM IC50 Eur. J. Med. Chem. (2015) 98: 127-138 [PMID:26005026]
aldo-keto reductase family 1 member B/Aldose reductase in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2622] [GtoPdb: 2768] [UniProtKB: P07943]
ChEMBL Inhibition of Fischer-344 rat kidney ALR1 using D,L-glyceraldehyde as substrate by spectrophotometry B 4.25 pIC50 56100 nM IC50 Bioorg. Med. Chem. (2013) 21: 869-873 [PMID:23312612]
ChEMBL Inhibition of Fischer-344 rat kidney ALR1 using D-glucuronate as substrate by spectrophotometry B 4.25 pIC50 56100 nM IC50 Bioorg. Med. Chem. (2014) 22: 2194-2207 [PMID:24630695]
ChEMBL Inhibition of ALR1 in Wistar rat kidney assessed as reduction in NADPH consumption preincubated for 1 min followed by substrate addition measured after 4 mins by spectrophotometric analysis B 4.25 pIC50 56100 nM IC50 Bioorg Med Chem (2017) 25: 6353-6360 [PMID:29074349]
Aldose reductase-related protein 1 in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3421523] [UniProtKB: Q5RJP0]
ChEMBL Inhibition of Wistar rat kidney aldehyde reductase using D-glucuronate as substrate by spectrophotometry B 4.25 pIC50 56100 nM IC50 J. Med. Chem. (2015) 58: 2649-2657 [PMID:25695864]
histone deacetylase 1/Histone deacetylase 1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL325] [GtoPdb: 2658] [UniProtKB: Q13547]
GtoPdb - - 3.4 pIC50 400000 nM IC50 J Biol Chem (2001) 276: 36734-41 [PMID:11473107]
ChEMBL Inhibition of human full-length recombinant HDAC1 preincubated for 5 mins followed by HDAC substrate addition and further incubated for 45 mins by fluorescence microplate reader assay B 4.07 pIC50 84210 nM IC50 Eur J Med Chem (2021) 222: 113569-113569 [PMID:34111829]
ChEMBL Inhibition of HADC1 (unknown origin) B 4.4 pIC50 40000 nM IC50 J Med Chem (2020) 63: 23-39 [PMID:31415174]
ChEMBL Inhibition of human recombinant HDAC1 B 4.41 pIC50 39000 nM IC50 ACS Med. Chem. Lett. (2011) 2: 39-42 [PMID:21874153]
histone deacetylase 2/Histone deacetylase 2 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1937] [GtoPdb: 2616] [UniProtKB: Q92769]
ChEMBL Inhibition of human recombinant HDAC2 B 4.21 pIC50 62000 nM IC50 ACS Med. Chem. Lett. (2011) 2: 39-42 [PMID:21874153]
sirtuin 5/NAD-dependent protein deacylase sirtuin-5, mitochondrial in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2163183] [GtoPdb: 2711] [UniProtKB: Q9NXA8]
ChEMBL Inhibition of SIRT5 B 4 pIC50 >100000 nM IC50 J. Med. Chem. (2012) 55: 5582-5590 [PMID:22583019]
Plasmodium falciparum (target type: ORGANISM) [ChEMBL: CHEMBL364]
ChEMBL Antimalarial activity against Plasmodium falciparum F 4 pIC50 >100000 nM IC50 J Med Chem (2017) 60: 4780-4804 [PMID:28241112]
Sigma-1 receptor in Guinea pig (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4153] [UniProtKB: Q60492]
ChEMBL Displacement of [3H]-pentazocine from sigma1 receptor in guinea pig brain membranes by scintillation counting B 5 pKi >10000 nM Ki J Med Chem (2016) 59: 9960-9966 [PMID:27739690]

ChEMBL data shown on this page come from version 31:

Gaulton A, Hersey A, Nowotka M, Bento AP, Chambers J, Mendez D, Mutowo P, Atkinson F, Bellis LJ, Cibrián-Uhalte E, Davies M, Dedman N, Karlsson A, Magariños MP, Overington JP, Papadatos G, Smit I, Leach AR. (2017) 'The ChEMBL database in 2017.' Nucleic Acids Res., 45(D1). DOI: 10.1093/nar/gkw1074. [PMCID:5210557]