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Assay Detail

CHEMBL4325327

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

Binding
Inhibition of N-terminal GST-tagged human ROCK1 catalytic domain (1 to 477 residues) expressed in baculovirus expression system using biotin-STK-substrate 2 as substrate preincubated with enzyme for 5 mins followed by ATP addition and measured after 2 hrs by TR-FRET assay
17
Total Activities
17
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

Rho-associated protein kinase 1 (CHEMBL3231)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery of a Novel, Highly Potent, and Selective Thieno[3,2-d]pyrimidinone-Based Cdc7 Inhibitor with a Quinuclidine Moiety (TAK-931) as an Orally Active Investigational Antitumor Agent.
Kurasawa O, Miyazaki T, Homma M, Oguro Y, Imada T, Uchiyama N, Iwai K, Yamamoto Y, Ohori M, Hara H, Sugimoto H, Iwata K, Skene R, Hoffman I, Ohashi A, Nomura T, Cho N.
J Med Chem (2020) 63 : 1084 -1104
PubMed 31895562 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 17 6.47 7.02

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4462898 1 7.02
CHEMBL4569914 1 6.89
CHEMBL4083927 1 6.85
CHEMBL4589689 1 6.80
CHEMBL4436649 1 6.66
CHEMBL4542797 1 6.57
CHEMBL4543158 1 6.47
CHEMBL4440266 1 6.44
CHEMBL4587191 1 6.43
CHEMBL4439133 1 6.38
CHEMBL4297644 SIMUROSERTIB 2.0 1 6.37
CHEMBL4529213 1 6.35
CHEMBL4572218 1 6.34
CHEMBL4570191 1 6.28
CHEMBL4462574 1 6.20
CHEMBL4457256 1 6.12
CHEMBL4561384 1 5.82

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4462898 IC50 = 96.0 nM 7.02
CHEMBL4569914 IC50 = 130.0 nM 6.89
CHEMBL4083927 IC50 = 140.0 nM 6.85
CHEMBL4589689 IC50 = 160.0 nM 6.80
CHEMBL4436649 IC50 = 220.0 nM 6.66
CHEMBL4542797 IC50 = 270.0 nM 6.57
CHEMBL4543158 IC50 = 340.0 nM 6.47
CHEMBL4440266 IC50 = 360.0 nM 6.44
CHEMBL4587191 IC50 = 370.0 nM 6.43
CHEMBL4439133 IC50 = 420.0 nM 6.38
CHEMBL4297644 SIMUROSERTIB IC50 = 430.0 nM 6.37
CHEMBL4529213 IC50 = 450.0 nM 6.35
CHEMBL4572218 IC50 = 460.0 nM 6.34
CHEMBL4570191 IC50 = 530.0 nM 6.28
CHEMBL4462574 IC50 = 630.0 nM 6.20
CHEMBL4457256 IC50 = 760.0 nM 6.12
CHEMBL4561384 IC50 = 1500.0 nM 5.82