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Assay Detail

CHEMBL4352155

Review assay metadata, readout intent, target linkage, and publication context from the same page.

Binding
Inhibition of (14-(2-{[3-({2-{[4-(cyanomethyl)phenyl]amino}-6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-4-pyrimidinyl}amino)propyl]amino}-2-oxoethyl)-16,16,18,18-tetramethyl-6,7,7a,8a,9,10,16,18-octahydrobenzo[2''3'']indolizino[8'',7'':5',6']pyrano[3',2':3,4]pyrido-[1,2-a]indol-5-ium-2-sulfonate binding to human GST/His-tagged RIP1 (1 to 375) expressed in baculovirus expression system preincubated for 10 mins followed by fluorescently labeled ATP-competitive ligand addition and measured after 20 mins by fluorescence polarization assay
72
Total Activities
72
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Receptor-interacting serine/threonine-protein kinase 1 (CHEMBL5464)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery and Lead-Optimization of 4,5-Dihydropyrazoles as Mono-Kinase Selective, Orally Bioavailable and Efficacious Inhibitors of Receptor Interacting Protein 1 (RIP1) Kinase.
Harris PA, Faucher N, George N, Eidam PM, King BW, White GV, Anderson NA, Bandyopadhyay D, Beal AM, Beneton V, Berger SB, Campobasso N, Campos S, Capriotti CA, Cox JA, Daugan A, Donche F, Fouchet MH, Finger JN, Geddes B, Gough PJ, Grondin P, Hoffman BL, Hoffman SJ, Hutchinson SE, Jeong JU, Jigorel E, Lamoureux P, Leister LK, Lich JD, Mahajan MK, Meslamani J, Mosley JE, Nagilla R, Nassau PM, Ng SL, Ouellette MT, Pasikanti KK, Potvain F, Reilly MA, Rivera EJ, Sautet S, Schaeffer MC, Sehon CA, Sun H, Thorpe JH, Totoritis RD, Ward P, Wellaway N, Wisnoski DD, Woolven JM, Bertin J, Marquis RW.
J Med Chem (2019) 62 : 5096 -5110
PubMed 31013427 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 72 7.84 8.00

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4474301 1 8.00
CHEMBL4594130 1 8.00
CHEMBL4454462 1 8.00
CHEMBL4457026 1 8.00
CHEMBL4443534 1 8.00
CHEMBL4556751 1 8.00
CHEMBL4454881 1 8.00
CHEMBL4561445 1 8.00
CHEMBL4450890 1 8.00
CHEMBL4541955 1 8.00
CHEMBL4514271 1 8.00
CHEMBL4545939 1 8.00
CHEMBL4455042 1 8.00
CHEMBL4471642 1 8.00
CHEMBL4436131 1 8.00
CHEMBL4527680 1 8.00
CHEMBL4474937 1 8.00
CHEMBL4564157 1 8.00
CHEMBL4452678 1 8.00
CHEMBL4554458 1 8.00
CHEMBL4519892 1 8.00
CHEMBL4575848 1 8.00
CHEMBL4565985 1 8.00
CHEMBL4553214 1 8.00
CHEMBL4474320 1 8.00
CHEMBL4463322 1 8.00
CHEMBL4526661 1 8.00
CHEMBL4448942 1 8.00
CHEMBL4588685 1 8.00
CHEMBL4548719 1 8.00

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4514028 IC50 = 10.0 nM 8.00
CHEMBL4443534 IC50 = 10.0 nM 8.00
CHEMBL4457026 IC50 = 10.0 nM 8.00
CHEMBL4454462 IC50 = 10.0 nM 8.00
CHEMBL4594130 IC50 = 10.0 nM 8.00
CHEMBL4552893 IC50 = 10.0 nM 8.00
CHEMBL4465743 IC50 = 10.0 nM 8.00
CHEMBL4524420 IC50 = 10.0 nM 8.00
CHEMBL4583157 IC50 = 10.0 nM 8.00
CHEMBL4548784 IC50 = 10.0 nM 8.00
CHEMBL4584779 IC50 = 10.0 nM 8.00
CHEMBL4437098 IC50 = 10.0 nM 8.00
CHEMBL4537171 IC50 = 10.0 nM 8.00
CHEMBL4556751 IC50 = 10.0 nM 8.00
CHEMBL4593226 IC50 = 10.0 nM 8.00
CHEMBL4436215 IC50 = 10.0 nM 8.00
CHEMBL4576386 IC50 = 10.0 nM 8.00
CHEMBL4556131 IC50 = 10.0 nM 8.00
CHEMBL4533161 IC50 = 10.0 nM 8.00
CHEMBL4436896 IC50 = 10.0 nM 8.00
CHEMBL4544356 IC50 = 10.0 nM 8.00
CHEMBL4446523 IC50 = 10.0 nM 8.00
CHEMBL4446758 IC50 = 10.0 nM 8.00
CHEMBL4448908 IC50 = 10.0 nM 8.00
CHEMBL4451628 IC50 = 10.0 nM 8.00
CHEMBL4564157 IC50 = 10.0 nM 8.00
CHEMBL4548719 IC50 = 10.0 nM 8.00
CHEMBL4588685 IC50 = 10.0 nM 8.00
CHEMBL4448942 IC50 = 10.0 nM 8.00
CHEMBL4526661 IC50 = 10.0 nM 8.00
CHEMBL4463322 IC50 = 10.0 nM 8.00
CHEMBL4474320 IC50 = 10.0 nM 8.00
CHEMBL4553214 IC50 = 10.0 nM 8.00
CHEMBL4565985 IC50 = 10.0 nM 8.00
CHEMBL4575848 IC50 = 10.0 nM 8.00
CHEMBL4519892 IC50 = 10.0 nM 8.00
CHEMBL4554458 IC50 = 10.0 nM 8.00
CHEMBL4452678 IC50 = 10.0 nM 8.00
CHEMBL4527680 IC50 = 10.0 nM 8.00
CHEMBL4474937 IC50 = 10.0 nM 8.00
CHEMBL4474301 IC50 = 10.0 nM 8.00
CHEMBL4436131 IC50 = 10.0 nM 8.00
CHEMBL4471642 IC50 = 10.0 nM 8.00
CHEMBL4455042 IC50 = 10.0 nM 8.00
CHEMBL4545939 IC50 = 10.0 nM 8.00
CHEMBL4514271 IC50 = 10.0 nM 8.00
CHEMBL4541955 IC50 = 10.0 nM 8.00
CHEMBL4450890 IC50 = 10.0 nM 8.00
CHEMBL4561445 IC50 = 10.0 nM 8.00
CHEMBL4454881 IC50 = 10.0 nM 8.00