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ChEMBL ligand: CHEMBL319144 (Acide minodronique, Acido minodronico, Minodronate, Minodronic acid, NSC-725590, ONO-5920, YM 529, YM-529, YM529) |
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DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
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farnesyl diphosphate synthase/Farnesyl diphosphate synthase in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1782] [GtoPdb: 644] [UniProtKB: P14324] | ||||||||
GtoPdb | Inhibition of human FPPS after 10 mins using [14C]IPP as substrate by liquid scintillation counting | - | 8.52 | pIC50 | 3 | nM | IC50 | J Med Chem (2010) 53: 3454-64 [PMID:20394422] |
ChEMBL | Inhibition of human FPPS after 10 mins using [14C]IPP as substrate by liquid scintillation counting | B | 8.52 | pIC50 | 3 | nM | IC50 | J Med Chem (2010) 53: 3454-3464 [PMID:20394422] |
ChEMBL | Inhibition of FDPS (unknown origin) | B | 8.52 | pIC50 | 3 | nM | IC50 | Bioorg Med Chem Lett (2019) 29: 126757-126757 [PMID:31699606] |
ChEMBL | Inhibition of human FPPS | B | 8.72 | pIC50 | 1.9 | nM | IC50 | Bioorg Med Chem Lett (2015) 25: 1117-1123 [PMID:25630225] |
Geranylgeranyl pyrophosphate synthase in Saccharomyces cerevisiae S288c (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1075251] [UniProtKB: Q12051] | ||||||||
ChEMBL | Binding affinity to Saccharomyces cerevisiae GGPPS | B | 6.89 | pKi | 130 | nM | Ki | Proc Natl Acad Sci U S A (2007) 104: 10022-10027 [PMID:17535895] |
ChEMBL | Inhibition of Saccharomyces cerevisiae GGPPS | B | 6.47 | pIC50 | 340 | nM | IC50 | Proc Natl Acad Sci U S A (2007) 104: 10022-10027 [PMID:17535895] |
geranylgeranyl diphosphate synthase/Geranylgeranyl pyrophosphate synthetase in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4769] [GtoPdb: 643] [UniProtKB: O95749] | ||||||||
ChEMBL | Binding affinity to human GGPPS | B | 5.74 | pKi | 1800 | nM | Ki | Proc Natl Acad Sci U S A (2007) 104: 10022-10027 [PMID:17535895] |
GtoPdb | Inhibition of human recombinant geranylgeranyl diphosphate synthase | - | 4 | pIC50 | - | - | - | J Med Chem (2008) 51: 5594-607 [PMID:18800762] |
ChEMBL | Inhibition of human recombinant geranylgeranyl diphosphate synthase | B | 4 | pIC50 | 100000 | nM | IC50 | J Med Chem (2008) 51: 5594-5607 [PMID:18800762] |
ChEMBL | Inhibition of human GGPPS | B | 4.19 | pIC50 | 65000 | nM | IC50 | Proc Natl Acad Sci U S A (2007) 104: 10022-10027 [PMID:17535895] |
GtoPdb | Inhibition of GGPPS after 10 mins using [14C]IPP as substrate by liquid scintillation counting | - | 6.17 | pIC50 | 670 | nM | IC50 | J Med Chem (2010) 53: 3454-64 [PMID:20394422] |
ChEMBL | Inhibition of GGPPS after 10 mins using [14C]IPP as substrate by liquid scintillation counting | B | 6.17 | pIC50 | 670 | nM | IC50 | J Med Chem (2010) 53: 3454-3464 [PMID:20394422] |
Geranyltranstransferase in Escherichia coli (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1075078] [UniProtKB: P22939] | ||||||||
ChEMBL | Inhibition of Escherichia coli FPPS | B | 5.96 | pIC50 | 1100 | nM | IC50 | J Med Chem (2006) 49: 7331-7341 [PMID:17149863] |
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]