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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| 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 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]
