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Assay Detail

CHEMBL3615799

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

Binding
Displacement of 5-({[2-({[3-({4-[(5-hydroxy-2-methylphenyl)amino]-2-pyrimidinyl}amino)phenyl]carbonyl}amino)-ethyl]amino}carbonyl)-2-(6-hydroxy-3-oxo-3H-xanthen-9-yl)benzoic acid from His6-MBP-TEV-full length human TNNI3K expressed in Baculovirus expression system after 60 mins by fluorescence polarization assay
57
Total Activities
57
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

Serine/threonine-protein kinase TNNI3K (CHEMBL5260)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Identification of Purines and 7-Deazapurines as Potent and Selective Type I Inhibitors of Troponin I-Interacting Kinase (TNNI3K).
Lawhorn BG, Philp J, Zhao Y, Louer C, Hammond M, Cheung M, Fries H, Graves AP, Shewchuk L, Wang L, Cottom JE, Qi H, Zhao H, Totoritis R, Zhang G, Schwartz B, Li H, Sweitzer S, Holt DA, Gatto GJ, Kallander LS.
J Med Chem (2015) 58 : 7431 -7448
PubMed 26355916 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 57 6.70 7.89

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3613307 1 7.89
CHEMBL3613186 1 7.89
CHEMBL3613199 1 7.89
CHEMBL3613187 1 7.89
CHEMBL3613189 1 7.89
CHEMBL3613185 1 7.89
CHEMBL3613309 1 7.80
CHEMBL3613193 1 7.70
CHEMBL3613190 1 7.70
CHEMBL3613184 1 7.60
CHEMBL3612666 1 7.50
CHEMBL3613181 1 7.50
CHEMBL3612665 1 7.50
CHEMBL3613306 1 7.40
CHEMBL3612661 1 7.40
CHEMBL3612667 1 7.40
CHEMBL3613176 1 7.40
CHEMBL3613196 1 7.40
CHEMBL3613195 1 7.30
CHEMBL3612646 1 7.30
CHEMBL3613183 1 7.30
CHEMBL3613179 1 7.30
CHEMBL3613177 1 7.20
CHEMBL3613188 1 7.20
CHEMBL3612647 1 7.10
CHEMBL3613178 1 7.00
CHEMBL3613180 1 7.00
CHEMBL3613182 1 7.00
CHEMBL3613191 1 7.00
CHEMBL3612663 1 6.90

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3613307 IC50 = 13.0 nM 7.89
CHEMBL3613186 IC50 = 13.0 nM 7.89
CHEMBL3613199 IC50 = 13.0 nM 7.89
CHEMBL3613187 IC50 = 13.0 nM 7.89
CHEMBL3613189 IC50 = 13.0 nM 7.89
CHEMBL3613185 IC50 = 13.0 nM 7.89
CHEMBL3613309 IC50 = 16.0 nM 7.80
CHEMBL3613193 IC50 = 20.0 nM 7.70
CHEMBL3613190 IC50 = 20.0 nM 7.70
CHEMBL3613184 IC50 = 25.0 nM 7.60
CHEMBL3612666 IC50 = 32.0 nM 7.50
CHEMBL3613181 IC50 = 32.0 nM 7.50
CHEMBL3612665 IC50 = 32.0 nM 7.50
CHEMBL3613196 IC50 = 40.0 nM 7.40
CHEMBL3612661 IC50 = 40.0 nM 7.40
CHEMBL3612667 IC50 = 40.0 nM 7.40
CHEMBL3613306 IC50 = 40.0 nM 7.40
CHEMBL3613176 IC50 = 40.0 nM 7.40
CHEMBL3613195 IC50 = 50.0 nM 7.30
CHEMBL3612646 IC50 = 50.0 nM 7.30
CHEMBL3613183 IC50 = 50.0 nM 7.30
CHEMBL3613179 IC50 = 50.0 nM 7.30
CHEMBL3613177 IC50 = 63.0 nM 7.20
CHEMBL3613188 IC50 = 63.0 nM 7.20
CHEMBL3612647 IC50 = 80.0 nM 7.10
CHEMBL3613178 IC50 = 100.0 nM 7.00
CHEMBL3613191 IC50 = 100.0 nM 7.00
CHEMBL3613180 IC50 = 100.0 nM 7.00
CHEMBL3613182 IC50 = 100.0 nM 7.00
CHEMBL3612663 IC50 = 126.0 nM 6.90
CHEMBL3612662 IC50 = 126.0 nM 6.90
CHEMBL3612664 IC50 = 126.0 nM 6.90
CHEMBL3613308 IC50 = 126.0 nM 6.90
CHEMBL3612079 IC50 = 160.0 nM 6.80
CHEMBL3612660 IC50 = 250.0 nM 6.60
CHEMBL3612650 IC50 = 400.0 nM 6.40
CHEMBL3612641 IC50 = 500.0 nM 6.30
CHEMBL3612657 IC50 = 500.0 nM 6.30
CHEMBL3613192 IC50 = 630.0 nM 6.20
CHEMBL3612651 IC50 = 2000.0 nM 5.70
CHEMBL3612642 IC50 = 3200.0 nM 5.50
CHEMBL3612658 IC50 = 5000.0 nM 5.30
CHEMBL3612655 IC50 = 6300.0 nM 5.20
CHEMBL3613194 IC50 = 6300.0 nM 5.20
CHEMBL3612654 IC50 = 8000.0 nM 5.10
CHEMBL3612649 IC50 = 8000.0 nM 5.10
CHEMBL3612644 IC50 = 8000.0 nM 5.10
CHEMBL3612656 IC50 = 13000.0 nM 4.89
CHEMBL3612659 IC50 = 16000.0 nM 4.80
CHEMBL3612645 IC50 = 16000.0 nM 4.80