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]
ChEMBL Inhibition of recombinant human IDO1 by colorimetric method B 4.94 pKi 11600 nM Ki Medchemcomm (2019) 10: 1740-1754 [PMID:32055299]
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 IDO (unknown origin) B 4 pIC50 100000 nM IC50 J Med Chem (2020) 63: 1490-1510 [PMID:31622096]
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]
ChEMBL Inhibition of human recombinant His6-tagged IDO1 expressed in Escherichia coli strain BL21DE3pLys B 4.11 pIC50 76900 nM IC50 Eur J Med Chem (2022) 227: 113967-113967 [PMID:34752953]
ChEMBL Inhibition of IDO1 (unknown origin) B 4.11 pIC50 76900 nM IC50 Eur J Med Chem (2021) 211: 113071-113071 [PMID:33341650]
ChEMBL Inhibition of recombinant human IDO1 expressed in COS1 cells by colorimetric method B 4.89 pIC50 12850 nM IC50 Medchemcomm (2019) 10: 1740-1754 [PMID:32055299]
ChEMBL Inhibition of recombinant human IDO using L-Trp as substrate incubated for 60 mins B 6.96 pIC50 110 nM IC50 J Med Chem (2020) 63: 1490-1510 [PMID:31622096]
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 human RIPK1 incubated for 40 min in presence of ATP by ADP-Glo luminescence kinase assay B 5.94 pIC50 1139 nM IC50 Bioorg Med Chem (2022) 59: 116686-116686 [PMID:35228069]
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 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]