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ChEMBL ligand: CHEMBL210858 |
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DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
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histone deacetylase 6/Histone deacetylase 6 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1865] [GtoPdb: 2618] [UniProtKB: Q9UBN7] | ||||||||
ChEMBL | Determination of IC50 values for inhibition of enzymatic assay of human HDAC6 with custom peptide substrate | B | 6.01 | pIC50 | 985.7 | nM | IC50 | HDAC6 screening dataset using tau-based substrate in an enzymatic assay yields selective inhibitors and activators |
Macrophage migration inhibitory factor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2085] [UniProtKB: P14174] | ||||||||
ChEMBL | Displacement of 4'-(7-Hydroxy-2-oxo-2H-chromen-3-yl)-[1,1'-biphenyl]-4-carboxylic acid from C-terminal His-tagged recombinant human MIF expressed in Escherichia coli BL21 (DE3) preincubated for 10 mins followed by probe addition and measured after 10 mins by fluorescence assay | B | 4.33 | pKd | 47000 | nM | Kd | J Med Chem (2020) 63: 11920-11933 [PMID:32940040] |
ChEMBL | Inhibition of C-terminal His-tagged recombinant human MIF expressed in Escherichia coli BL21 (DE3) using 4-HPP as substrate preincubated for 10 mins followed by substrate addition by UV absorption spectrum analysis | B | 4.36 | pKi | 44000 | nM | Ki | J Med Chem (2020) 63: 11920-11933 [PMID:32940040] |
ChEMBL | Inhibition of C-terminal His-tagged recombinant human MIF tautomerase activity expressed in Escherichia coli BL21 using 4-hydroxyphenyl pyruvic acid as substrate preincubated for 15 mins followed by substrate addition and measured for 10 mins in presence of 0.5 mM EDTA by UV absorbance based Cheng-Prusoff equation analysis | B | 4.36 | pKi | 44000 | nM | Ki | Eur J Med Chem (2020) 186: 111849-111849 [PMID:31767137] |
ChEMBL | Inhibition of MIF tautomerase (unknown origin) using 4-HPP as substrate preincubated for 1 hr followed by substrate addition by Lineweaver-Burk plot anlysis | B | 4.36 | pKi | 43500 | nM | Ki | Bioorg Med Chem Lett (2022) 55: 128445-128445 [PMID:34758374] |
ChEMBL | Inhibition of dopachrome tautomerase activity of human recombinant MIF | B | 4 | pIC50 | >100000 | nM | IC50 | Bioorg Med Chem Lett (2009) 19: 4773-4776 [PMID:19592246] |
ChEMBL | Inhibition of recombinant His-tagged MIF tautomerase activity (unknown origin) using 4-HPP as substrate | B | 4.1 | pIC50 | 79000 | nM | IC50 | Bioorg Med Chem (2018) 26: 999-1005 [PMID:29428527] |
ChEMBL | Inhibition of dopachrome tautomerase activity of MIF in human THP1 cells | B | 4.16 | pIC50 | 69000 | nM | IC50 | Bioorg Med Chem Lett (2009) 19: 4773-4776 [PMID:19592246] |
ChEMBL | Inhibition of MIF tautomerase (unknown origin) using 4-HPP as substrate preincubated for 1 hr followed by substrate addition | B | 4.19 | pIC50 | 65300 | nM | IC50 | Bioorg Med Chem Lett (2022) 55: 128445-128445 [PMID:34758374] |
ChEMBL | Inhibition of C-terminal His-tagged recombinant human MIF tautomerase activity expressed in Escherichia coli BL21 using 4-hydroxyphenyl pyruvic acid as substrate preincubated for 15 mins followed by substrate addition and measured for 10 mins in presence of 0.5 mM EDTA by UV absorbance analysis | B | 4.19 | pIC50 | 64000 | nM | IC50 | Eur J Med Chem (2020) 186: 111849-111849 [PMID:31767137] |
ChEMBL | Inhibition of spontaneous secretion/release/recognition of MIF from freshly isolated human PBMC by ELISA | B | 4.6 | pIC50 | 25000 | nM | IC50 | Bioorg Med Chem Lett (2009) 19: 4773-4776 [PMID:19592246] |
ChEMBL | Inhibition of recombinant human MIF (Pro2 to Ala115 residues) expressed in Escherichia coli using dopachrome methyl ester as substrate preincubated with protein followed by substrate addition | B | 4.74 | pIC50 | 18200 | nM | IC50 | J Med Chem (2018) 61: 8104-8119 [PMID:29812929] |
ChEMBL | Inhibition of MIF tautomerase activity | B | 4.96 | pIC50 | 11000 | nM | IC50 | Bioorg Med Chem Lett (2006) 16: 3376-3379 [PMID:16682188] |
ChEMBL | Inhibition of recombinant MIF (unknown origin) tautomerase activity using dopachrome methyl ester as substrate measured for 2 to 20 secs by spectrophotometric analysis | B | 5.15 | pIC50 | 7000 | nM | IC50 | J Med Chem (2018) 61: 8104-8119 [PMID:29812929] |
Macrophage migration inhibitory factor in Mouse (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1926491] [UniProtKB: P34884] | ||||||||
ChEMBL | Enzyme Assay: MIF tautomerase activity was measured by UV-Visible recording spectrophotometry (SHIMADZU, UV1600U). A fresh stock solution of L-dopachrome methyl ester was prepared at 2.4 mM through oxidation of L-3,4-dihydroxyphenylalanine methyl ester with sodium periodate. 1 μL of MIF solution (800-900 ng/mL) and 1 μL of a DMSO solution with various concentrations of the enzymatic inhibitor were added into a plastic cuvette (10 mm, 1.5 mL) containing 0.7 mL assay buffer (50 mM potassium phosphate, pH 7.2). Then L-dopachrome methyl ester solution (0.3 mL) was added to the assay buffer mixture. Activity was determined at room temperature and the spectrometric measurements were made at λ=475 nm for 20 seconds by monitoring the rate of decolorization of L-dopachrome methyl ester in comparison to a standard solution. | B | 4.96 | pIC50 | 11000 | nM | IC50 | US-8618147-B2. Modified macrophage migration inhibitory factor inhibitors (2013) |
sigma non-opioid intracellular receptor 1/Sigma opioid receptor in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3602] [GtoPdb: 2552] [UniProtKB: Q9R0C9] | ||||||||
ChEMBL | Displacement of [3H]-(+)-pentazocine from sigma 1 receptor in rat brain by competition binding assay | B | 6.99 | pKi | 102.3 | nM | Ki | Medchemcomm (2015) 6: 1093-1103 |
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]