isopentenyl diphosphate [Ligand Id: 3048] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL356362 (Isopentenylpyrophosphate, Isopentenyl Pyrophosphate)
  • butyrophilin subfamily 3 member A1/Butyrophilin subfamily 3 member A1 in Human [ChEMBL: CHEMBL4105758] [GtoPdb: 2948] [UniProtKB: O00481]
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  • TRPA1 in Mouse [GtoPdb: 485] [UniProtKB: Q8BLA8]
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  • TRPV3 in Human [GtoPdb: 509] [UniProtKB: Q8NET8]
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  • mevalonate kinase in Human [GtoPdb: 640] [UniProtKB: Q03426]
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  • farnesyl diphosphate synthase in Human [GtoPdb: 644] [UniProtKB: P14324]
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
butyrophilin subfamily 3 member A1/Butyrophilin subfamily 3 member A1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4105758] [GtoPdb: 2948] [UniProtKB: O00481]
ChEMBL Activation of BTN3A1 in human PBMC-derived Vgamma9/Vdelta2 T cells assessed as induction of IL2-stimulated IFNgamma production measured after 48 hrs by ELISA B 4.15 pEC50 71000 nM EC50 J Med Chem (2019) 62: 6814-6823 [PMID:31268699]
ChEMBL Activation of BTN3A1 in human PBMC-derived Vgamma9/Vdelta2 T cells assessed as induction of IL2-stimulated cell proliferation by measuring increase in CD3+ cells preincubated for 3 days followed by 11 days incubation post compound washout and subsequent IL2 stimulation for every 3 days measured after 14 days by flow cytometry B 4.44 pEC50 36000 nM EC50 J Med Chem (2019) 62: 6814-6823 [PMID:31268699]
ChEMBL Binding affinity to BTN3A1 in human PBMC-derived Vgamma9/Vdelta2 T cells B 6 pEC50 1000 nM EC50 J Med Chem (2020) 63: 11258-11270 [PMID:32930595]
TRPA1 in Mouse [GtoPdb: 485] [UniProtKB: Q8BLA8]
GtoPdb Calcium imaging - 5.1 pIC50 - - - Br J Pharmacol (2010) 161: 707-20 [PMID:20880407]
TRPV3 in Human [GtoPdb: 509] [UniProtKB: Q8NET8]
GtoPdb Calcium imaging - 6.62 pIC50 239 nM IC50 Pain (2011) 152: 1156-64 [PMID:21353389]
mevalonate kinase in Human [GtoPdb: 640] [UniProtKB: Q03426]
GtoPdb recombinant enzyme expressed in E coli cells. Spectrophotometric assay - 4.8 pKi 16000 nM Ki J Lipid Res (1997) 38: 2216-23 [PMID:9392419]
farnesyl diphosphate synthase in Human [GtoPdb: 644] [UniProtKB: P14324]
GtoPdb value not verified - 6.15 pKi 700 nM - Meth Enzymol (1985) 110: 155-67 [PMID:4021811]

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]