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ChEMBL ligand: CHEMBL572 (Berkfurin, Ceduran, Dantafur, Furadantin, Furalan, Genfura, Ivadantin, Macrobid, Macrodantin, Nitrofurantoin, Nitrofurantoina, Nitrofurantoin anhydrous, Nitrofurantoine, Nitrofurantoin macrocrystal, Nitrofurantoin macrocrystalline, Nitrofurantoin, macrocrystalline, Nitrofurantoin, macrocrystals, Nitrofurantoin (monohydrate/macrocrystals), Nitrofurantoinum anhydrous, NSC-2107, NSC-44150) |
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DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
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CDGSH iron-sulfur domain-containing protein 1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1795168] [UniProtKB: Q9NZ45] | ||||||||
ChEMBL | Displacement of [3H]rosiglitazone from recombinant human C-terminal His-tagged MitoNEET cytosolic domain (32 to 108 residues) expressed in Escherichia coli BL21 by Cheng-Prusoff analysis | B | 6.09 | pKi | 816 | nM | Ki | Bioorg Med Chem Lett (2016) 26: 5350-5353 [PMID:27687671] |
ChEMBL | Displacement of [3H]rosiglitazone from recombinant human C-terminal His-tagged MitoNEET cytosolic domain (32 to 108 residues) expressed in Escherichia coli BL21 by scintillation proximity assay | B | 4.72 | pIC50 | 19100 | nM | IC50 | Bioorg Med Chem Lett (2016) 26: 5350-5353 [PMID:27687671] |
GroEL/GroES in Escherichia coli (target type: PROTEIN COMPLEX) [ChEMBL: CHEMBL4106139] [UniProtKB: Q548M1, Q7BGE6] | ||||||||
ChEMBL | Inhibition of Escherichia coli GroEL/ES-mediated refolding of the denatured malate dehydrogenase | B | 4 | pIC50 | >100000 | nM | IC50 | Bioorg Med Chem (2020) 28: 115710-115710 [PMID:33007545] |
ChEMBL | Inhibition of Escherichia coli GroEL/ES-mediated refolding of the denatured malate dehydrogenase in presence of Escherichia coli type 1 NfsB nitroreductase | B | 4.08 | pIC50 | 84000 | nM | IC50 | Bioorg Med Chem (2020) 28: 115710-115710 [PMID:33007545] |
ChEMBL | Inhibition of Escherichia coli GroEL/ES assessed as inhibition of native malate dehydrogenase treated after denatured malate dehydrogenase completely refold | B | 4.2 | pIC50 | >63000 | nM | IC50 | Bioorg Med Chem (2020) 28: 115710-115710 [PMID:33007545] |
ChEMBL | Inhibition of Escherichia coli GroEL/ES assessed as inhibition of native malate dehydrogenase treated after denatured malate dehydrogenase completely refold in presence of NfsB nitroreductase | B | 4.25 | pIC50 | >56000 | nM | IC50 | Bioorg Med Chem (2020) 28: 115710-115710 [PMID:33007545] |
mitochondrial pyruvate carrier 2 in Human [GtoPdb: 3023] [UniProtKB: O95563] | ||||||||
GtoPdb | - | - | 5.48 | pIC50 | 3300 | nM | IC50 | Mol Metab (2022) 60: 101469 [PMID:35278701] |
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]