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Assay Detail

CHEMBL4023993

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

Binding
Inhibition of fluorescent-labeled 3-(3-((3-(4-amino-5-(4-(3-(2-fluoro-5-(trifluoromethyl)phenyl)ureido)-phenyl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl)propyl)amino)-3-oxopropyl)-5,5-difluoro-7,9-dimethyl-5H-dipyrrolo[1,2-c:2',1'-f]-[1,3,2]diazaborinin-4-ium-5-uide binding to human N-terminal GST/His-tagged RIPK1 (1 to 375 residues) expressed in baculovirus expression system by TR-FRET assay
27
Total Activities
27
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 of 7-Oxo-2,4,5,7-tetrahydro-6 H-pyrazolo[3,4- c]pyridine Derivatives as Potent, Orally Available, and Brain-Penetrating Receptor Interacting Protein 1 (RIP1) Kinase Inhibitors: Analysis of Structure-Kinetic Relationships.
Yoshikawa M, Saitoh M, Katoh T, Seki T, Bigi SV, Shimizu Y, Ishii T, Okai T, Kuno M, Hattori H, Watanabe E, Saikatendu KS, Zou H, Nakakariya M, Tatamiya T, Nakada Y, Yogo T.
J Med Chem (2018) 61 : 2384 -2409
PubMed 29485864 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 27 8.03 9.39

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4075976 1 9.39
CHEMBL4061975 1 9.07
CHEMBL4069537 1 9.04
CHEMBL4100398 1 9.04
CHEMBL4071864 GSK2982772 2.0 1 9.01
CHEMBL4084681 1 8.94
CHEMBL4082215 1 8.94
CHEMBL4090975 1 8.76
CHEMBL4075705 1 8.75
CHEMBL247228 GW770249X 1 8.69
CHEMBL4102622 1 8.60
CHEMBL4064701 1 8.59
CHEMBL4085728 1 8.53
CHEMBL4073321 1 8.46
CHEMBL4088216 TP-030-1 1 8.41
CHEMBL4071690 1 8.29
CHEMBL4098708 1 8.10
CHEMBL4060308 1 7.86
CHEMBL4090065 1 7.47
CHEMBL4076592 1 7.42
CHEMBL4100309 1 7.26
CHEMBL4077039 1 7.20
CHEMBL4066941 1 6.97
CHEMBL4082291 1 6.93
CHEMBL4063075 1 6.60
CHEMBL4079755 1 5.37
CHEMBL4097778 TP-030n 1 5.16

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4075976 Ki = 0.4074 nM 9.39
CHEMBL4061975 Ki = 0.8511 nM 9.07
CHEMBL4069537 Ki = 0.912 nM 9.04
CHEMBL4100398 Ki = 0.912 nM 9.04
CHEMBL4071864 GSK2982772 Ki = 0.9772 nM 9.01
CHEMBL4084681 Ki = 1.148 nM 8.94
CHEMBL4082215 Ki = 1.148 nM 8.94
CHEMBL4090975 Ki = 1.738 nM 8.76
CHEMBL4075705 Ki = 1.778 nM 8.75
CHEMBL247228 GW770249X Ki = 2.042 nM 8.69
CHEMBL4102622 Ki = 2.512 nM 8.60
CHEMBL4064701 Ki = 2.57 nM 8.59
CHEMBL4085728 Ki = 2.951 nM 8.53
CHEMBL4073321 Ki = 3.467 nM 8.46
CHEMBL4088216 TP-030-1 Ki = 3.89 nM 8.41
CHEMBL4071690 Ki = 5.129 nM 8.29
CHEMBL4098708 Ki = 7.943 nM 8.10
CHEMBL4060308 Ki = 13.8 nM 7.86
CHEMBL4090065 Ki = 33.88 nM 7.47
CHEMBL4076592 Ki = 38.02 nM 7.42
CHEMBL4100309 Ki = 54.95 nM 7.26
CHEMBL4077039 Ki = 63.1 nM 7.20
CHEMBL4066941 Ki = 107.15 nM 6.97
CHEMBL4082291 Ki = 117.49 nM 6.93
CHEMBL4063075 Ki = 251.19 nM 6.60
CHEMBL4079755 Ki = 4265.8 nM 5.37
CHEMBL4097778 TP-030n Ki = 6918.31 nM 5.16