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ChEMBL ligand: CHEMBL98 (MK-0683, MK0683, NSC-701852, NSC-748799, NSC-759852, Suberoylanilide hydroxamic acid, Vorinostat, Zolinza) |
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DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
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Amyloid-beta A4 protein in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2487] [UniProtKB: P05067] | ||||||||
ChEMBL | Inhibition of amyloid beta (1 to 42) (unknown origin) self aggregation after 24 hrs by thioflavin-T fluorescence method | B | 4.7 | pIC50 | >20000 | nM | IC50 | Eur J Med Chem (2020) 192: 112193-112193 [PMID:32151835] |
Apoptosis regulator BAX in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5318] [UniProtKB: Q07812] | ||||||||
ChEMBL | Binding affinity to recombinant human full length His-tagged BAX expressed in Escherichia coli BL21 (DE3) cells preincubated for 30 min followed by FITC-BIM addition and measured after 20 mins by fluorescence polarization assay | B | 5 | pEC50 | >10000 | nM | EC50 | J Med Chem (2020) 63: 12083-12099 [PMID:33021789] |
bromodomain containing 4/Bromodomain-containing protein 4 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1163125] [GtoPdb: 1945] [UniProtKB: O60885] | ||||||||
ChEMBL | Inhibition of recombinant BRD4 bromodomain 1 (unknown origin) using histone H4 peptide as substrate incubated for 1 hr under dark condition by HTRF assay | B | 4.3 | pIC50 | >50000 | nM | IC50 | Medchemcomm (2014) 5: 342-351 |
ChEMBL | Inhibition of His-tagged BRD4 bromodomain 1 (unknown origin) using [Lys (5,8,12,16) Ac] H4(1-21) as substrate by fluorescence based assay | B | 5 | pIC50 | >10000 | nM | IC50 | Eur J Med Chem (2021) 209: 112868-112868 [PMID:33077265] |
ChEMBL | Inhibition of His-tagged BRD4 bromodomain 2 (unknown origin) using [Lys (5,8,12,16) Ac] H4(1-21) as substrate by fluorescence based assay | B | 5 | pIC50 | >10000 | nM | IC50 | Eur J Med Chem (2021) 209: 112868-112868 [PMID:33077265] |
ChEMBL | Inhibition of BRD4 in human HL60 cells assessed as reduction in C-myc production after 24 hrs by ELISA | B | 6.13 | pIC50 | 740 | nM | IC50 | Bioorg Med Chem (2017) 25: 3677-3684 [PMID:28549889] |
ChEMBL | Inhibition of BRD4 (unknown origin) by ELISA | B | 7.37 | pIC50 | 43.13 | nM | IC50 | Bioorg Med Chem Lett (2021) 31: 127671-127671 [PMID:33229136] |
ChEMBL | Inhibition of BRD4 (unknown origin) | B | 8 | pIC50 | 10 | nM | IC50 | Bioorg Med Chem Lett (2017) 27: 4051-4055 [PMID:28765013] |
DNA methyltransferase 1/DNA (cytosine-5)-methyltransferase 1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1993] [GtoPdb: 2605] [UniProtKB: P26358] | ||||||||
ChEMBL | Inhibition of human DNMT1 enzyme using polydeoxy-inosine polydeoxy-cytosine DNA as substrate incubated for 15 mins in presence of SAM by TR-FRET assay | B | 5 | pIC50 | >10000 | nM | IC50 | J Med Chem (2021) 64: 3392-3426 [PMID:33661013] |
epidermal growth factor receptor/Epidermal growth factor receptor erbB1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL203] [GtoPdb: 1797] [UniProtKB: P00533] | ||||||||
ChEMBL | Inhibition of EGFR (unknown origin) | B | 6.05 | pIC50 | 900 | nM | IC50 | J Med Chem (2020) 63: 8977-9002 [PMID:32320239] |
ChEMBL | Inhibition of EGFR (unknown origin) | B | 7.92 | pIC50 | 12 | nM | IC50 | Eur J Med Chem (2021) 209: 112904-112904 [PMID:33077264] |
histone deacetylase 1/HDAC1/REST corepressor 3 in Human (target type: PROTEIN COMPLEX) [ChEMBL: CHEMBL4296112] [GtoPdb: 2658] [UniProtKB: Q13547, Q9P2K3] | ||||||||
ChEMBL | Inhibition of HDAC1/CoREST3 in HEK293 whole cell extract using fluorescent acetylated histone peptide as substrate after 60 mins by fluorescence based assay | B | 8.52 | pKi | 3.04 | nM | Ki | Bioorg Med Chem Lett (2018) 28: 1001-1004 [PMID:29496367] |
GtoPdb | - | - | 8.89 | pKi | 1.3 | nM | Ki | Nat Chem Biol (2010) 6: 238-243 [PMID:20139990] |
heat shock protein 90 alpha family class A member 1/Heat shock protein HSP 90-alpha in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3880] [GtoPdb: 2905] [UniProtKB: P07900] | ||||||||
ChEMBL | Inhibition of FITC-geldanamycin binding to HSP90alpha (unknown origin) after 3 hrs by fluorescence polarization assay | B | 6 | pIC50 | >1000 | nM | IC50 | Eur J Med Chem (2018) 150: 667-677 [PMID:29567459] |
ChEMBL | Inhibition of HSP90a (unknown origin) | B | 6 | pIC50 | >1000 | nM | IC50 | Eur J Med Chem (2020) 190: 112086-112086 [PMID:32058238] |
Kv11.1/HERG in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL240] [GtoPdb: 572] [UniProtKB: Q12809] | ||||||||
ChEMBL | Inhibition of human ERG by automated patch clamp assay | B | 4.52 | pIC50 | >30000 | nM | IC50 | Bioorg Med Chem Lett (2011) 21: 4909-4912 [PMID:21742496] |
ChEMBL | Inhibition of human ERG by automated Q-patch assay | B | 4.52 | pIC50 | >30000 | nM | IC50 | J Med Chem (2011) 54: 4752-4772 [PMID:21650221] |
ChEMBL | Inhibition of recombinant human ERG expressed in HEK293 cells at -80 mV holding potential measured for 9 mins by Qpatch clamp method | B | 4.52 | pIC50 | >30000 | nM | IC50 | Bioorg Med Chem Lett (2017) 27: 4885-4888 [PMID:28947154] |
ChEMBL | Inhibition of human ERG | B | 6.49 | pIC50 | 322 | nM | IC50 | Eur J Med Chem (2020) 206: 112677-112677 [PMID:32823005] |
Histone deacetylase in Plasmodium falciparum (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5541] [UniProtKB: Q9XYC7] | ||||||||
ChEMBL | Inhibition of Plasmodium falciparum HDAC1 | B | 6.89 | pIC50 | 130 | nM | IC50 | J Med Chem (2010) 53: 6100-6111 [PMID:20669972] |
ChEMBL | Inhibition of Plasmodium falciparum HDAC1 expressed in Drosophila melanogaster S2 cells | B | 7.23 | pIC50 | 59 | nM | IC50 | J Med Chem (2009) 52: 2185-2187 [PMID:19317450] |
Plasmodium falciparum histone deacetylase 1/Histone deacetylase in Plasmodium falciparum 3D7 (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1293190] [GtoPdb: 3072] [UniProtKB: Q7K6A1] | ||||||||
ChEMBL | Inhibition of Plasmodium falciparum 3D7 histone deacetylase infected in human erythrocytes assessed as alteration of histone H3 acetylation after 3.5 hrs by SDS-PAGE | B | 7 | pIC50 | 100 | nM | IC50 | Antimicrob Agents Chemother (2008) 52: 3467-3477 [PMID:18644969] |
histone deacetylase 1/Histone deacetylase 1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL325] [GtoPdb: 2658] [UniProtKB: Q13547] | ||||||||
ChEMBL | Inhibition of recombinant human HDAC1 using Boc-L-Lys(acetyl)-MCA as substrate by fluorogenic enzymatic assay | B | 7.4 | pKd | 40 | nM | Kd | Bioorg Med Chem (2012) 20: 985-995 [PMID:22182579] |
ChEMBL | Inhibition of HDAC1 | B | 7.2 | pKi | 63 | nM | Ki | Bioorg Med Chem Lett (2010) 20: 3314-3321 [PMID:20451378] |
ChEMBL | Competitive inhibition of HDAC1 using KI-104 as substrate by fluorescence assay | B | 7.22 | pKi | 60 | nM | Ki | J Med Chem (2011) 54: 4694-4720 [PMID:21634430] |
ChEMBL | Inhibition of HDAC1 | B | 7.32 | pKi | 48 | nM | Ki | J Med Chem (2008) 51: 2898-2906 [PMID:18412327] |
ChEMBL | Inhibition of human recombinant HDAC1 using Fluor de Lys as substrate after 2 hrs by fluorescence method | B | 7.92 | pKi | 12 | nM | Ki | Bioorg Med Chem Lett (2018) 28: 2985-2992 [PMID:30122227] |
ChEMBL | Inhibition of human recombinant HDAC1 using Ac-Leu-Gly-Lys (Ac)-AMC substrate incubated for 30 mins by fluorescence assay | B | 8 | pKi | 10 | nM | Ki | Medchemcomm (2014) 5: 1849-1855 |
ChEMBL | Inhibition of human recombinant HDAC1 using [Ac-Leu-Gly-Lys(Ac)-AMC substrate incubated for 15 to 30 mins | B | 8.1 | pKi | 8 | nM | Ki | J Med Chem (2014) 57: 9644-9657 [PMID:25380299] |
ChEMBL | Inhibition of recombinant human HDAC1 enzyme using flurogenic Ac-LeuGlyLys (Ac)-AMC as substrate after 15 to 30 mins | B |