necrostatin-1 [Ligand Id: 9750] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL195008 (Necrostatin, Necrostatin-1)
  • indoleamine 2,3-dioxygenase 1/Indoleamine 2,3-dioxygenase in Human [ChEMBL: CHEMBL4685] [GtoPdb: 2829] [UniProtKB: P14902]
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  • receptor interacting serine/threonine kinase 1/Receptor-interacting serine/threonine-protein kinase 1 in Human [ChEMBL: CHEMBL5464] [GtoPdb: 2189] [UniProtKB: Q13546]
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
indoleamine 2,3-dioxygenase 1/Indoleamine 2,3-dioxygenase in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4685] [GtoPdb: 2829] [UniProtKB: P14902]
ChEMBL Competitive inhibition of 6His-tagged human recombinant IDO expressed in Escherichia coli BL21DE3pLys B 4.92 pKi 12000 nM Ki J. Med. Chem. (2015) 58: 9421-9437 [PMID:25970480]
GtoPdb Using a purified recombinant human IDO enzyme for in vitro>/i> assays. - 4.94 pKi 11600 nM Ki Nat. Med. (2005) 11: 312-9 [PMID:15711557]
ChEMBL Inhibition of human recombinant IDO assessed as inhibition of indoleamine 2,3-dioxygenase to kynurenine conversion after 60 mins by HPLC analysis B 4.94 pKi 11400 nM Ki Bioorg. Med. Chem. (2013) 21: 1159-1165 [PMID:23337802]
ChEMBL Inhibition of IDO1 (unknown origin) B 4.94 pKi 11400 nM Ki J. Med. Chem. (2015) 58: 8762-8782 [PMID:26207924]
ChEMBL Inhibition of IDO1 (unknown origin) B 4.94 pKi 11400 nM Ki Eur J Med Chem (2017) 138: 199-211 [PMID:28667875]
ChEMBL Inhibition of human recombinant IDO assessed as inhibition of indoleamine 2,3-dioxygenase to kynurenine conversion after 60 mins by HPLC analysis B 4.11 pIC50 76900 nM IC50 Bioorg. Med. Chem. (2013) 21: 1159-1165 [PMID:23337802]
receptor interacting serine/threonine kinase 1/Receptor-interacting serine/threonine-protein kinase 1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5464] [GtoPdb: 2189] [UniProtKB: Q13546]
ChEMBL Inhibition of recombinant GST-tagged RIP1 (unknown origin) after 4 hrs by ADP-Glo kinase assay B 6.12 pIC50 760 nM IC50 J Med Chem (2017) 60: 972-986 [PMID:27992216]
GtoPdb Measuring inhibition of cellular necrosis in TNFα-treated FADD-deficient Jurkat cells. - 6.31 pIC50 490 nM IC50 Nat. Chem. Biol. (2008) 4: 313-21 [PMID:18408713]
ChEMBL Inhibition of recombinant human GST-fused RIPK1 (1 to 497 residues) expressed in baculovirus infected insect Sf9 cells in presence of 32P-gamma-ATP after 30 mins by autoradiogram-based Western blot method B 6.74 pIC50 182 nM IC50 Nat Rev Drug Discov (2017) 16: 424-440 [PMID:28280261]
ChEMBL Inhibition of endogenous RIP1 autophosphorylation in human Jurkat cells B 6.74 pEC50 182 nM EC50 Nat. Chem. Biol. (2008) 4: 313-321 [PMID:18408713]

ChEMBL data shown on this page come from version 27:

Gaulton A, Hersey A, Nowotka M, Bento AP, Chambers J, Mendez D, Mutowo P, Atkinson F, Bellis LJ, CibriƔn-Uhalte E, Davies M, Dedman N, Karlsson A, MagariƱos MP, Overington JP, Papadatos G, Smit I, Leach AR. (2017) 'The ChEMBL database in 2017.' Nucleic Acids Res., 45(D1). DOI: 10.1093/nar/gkw1074. [PMCID:5210557]