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Assay Detail

CHEMBL5160033

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

Toxicity
Inhibition of human Haspin kinase domain using histone H3 biotin peptide as substrate preincubated with enzyme for 30 mins followed by substrate and ATP addition for 90 mins by luminescence based analysis
20
Total Activities
20
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Serine/threonine-protein kinase haspin (CHEMBL1075163)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery and Preclinical Pharmacology of INE963, a Potent and Fast-Acting Blood-Stage Antimalarial with a High Barrier to Resistance and Potential for Single-Dose Cures in Uncomplicated Malaria.
Taft BR, Yokokawa F, Kirrane T, Mata AC, Huang R, Blaquiere N, Waldron G, Zou B, Simon O, Vankadara S, Chan WL, Ding M, Sim S, Straimer J, Guiguemde A, Lakshminarayana SB, Jain JP, Bodenreider C, Thompson C, Lanshoeft C, Shu W, Fang E, Qumber J, Chan K, Pei L, Chen YL, Schulz H, Lim J, Abas SN, Ang X, Liu Y, Angulo-Barturen I, Jiménez-Díaz MB, Gamo FJ, Crespo-Fernandez B, Rosenthal PJ, Cooper RA, Tumwebaze P, Aguiar ACC, Campo B, Campbell S, Wagner J, Diagana TT, Sarko C.
J Med Chem (2022) 65 : 3798 -3813
PubMed 35229610 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 20 6.47 8.52

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL5201780 1 8.52
CHEMBL5201904 1 8.30
CHEMBL5179988 1 7.96
CHEMBL5187817 1 7.50
CHEMBL5192443 1 7.35
CHEMBL5187610 1 7.11
CHEMBL5170360 1 6.85
CHEMBL5195201 1 6.70
CHEMBL5207627 1 6.16
CHEMBL5204715 1 6.11
CHEMBL5200247 1 5.89
CHEMBL5181699 1 5.88
CHEMBL5189523 1 5.76
CHEMBL5189235 1 5.39
CHEMBL5173325 1 5.30
CHEMBL5196893 1 5.28
CHEMBL5173264 INE-963 2.0 1 5.26
CHEMBL5191906 1 5.09
CHEMBL5176864 1 -
CHEMBL5199414 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL5201780 IC50 = 3.0 nM 8.52
CHEMBL5201904 IC50 = 5.0 nM 8.30
CHEMBL5179988 IC50 = 11.0 nM 7.96
CHEMBL5187817 IC50 = 32.0 nM 7.50
CHEMBL5192443 IC50 = 45.0 nM 7.35
CHEMBL5187610 IC50 = 78.0 nM 7.11
CHEMBL5170360 IC50 = 140.0 nM 6.85
CHEMBL5195201 IC50 = 200.0 nM 6.70
CHEMBL5207627 IC50 = 690.0 nM 6.16
CHEMBL5204715 IC50 = 770.0 nM 6.11
CHEMBL5200247 IC50 = 1280.0 nM 5.89
CHEMBL5181699 IC50 = 1330.0 nM 5.88
CHEMBL5189523 IC50 = 1740.0 nM 5.76
CHEMBL5189235 IC50 = 4040.0 nM 5.39
CHEMBL5173325 IC50 = 4960.0 nM 5.30
CHEMBL5196893 IC50 = 5310.0 nM 5.28
CHEMBL5173264 INE-963 IC50 = 5500.0 nM 5.26
CHEMBL5191906 IC50 = 8070.0 nM 5.09
CHEMBL5176864 IC50 > 10000.0 nM -
CHEMBL5199414 IC50 > 30000.0 nM -