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SMILES: CNS(=O)(=O)c1ccc(C)c(Nc2ncnc3[nH]cnc23)c1

InChI Key: InChIKey=HAPJCFVQJHLPFJ-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50118407   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Serine/threonine-protein kinase TNNI3K


(Homo sapiens (Human))		BDBM50118407
PNG
(CHEMBL3612657)
Show SMILES CNS(=O)(=O)c1ccc(C)c(Nc2ncnc3[nH]cnc23)c1
Show InChI InChI=1S/C13H14N6O2S/c1-8-3-4-9(22(20,21)14-2)5-10(8)19-13-11-12(16-6-15-11)17-7-18-13/h3-7,14H,1-2H3,(H2,15,16,17,18,19)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 500n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
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...

J Med Chem 58: 7431-48 (2015)


BindingDB Entry DOI: 10.7270/Q2FT8NV1
More data for this
Ligand-Target Pair