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SMILES: CNS(=O)(=O)c1cccc(Nc2cc(Nc3ccc(cn3)C(F)(F)F)ncn2)c1

InChI Key: InChIKey=HDKFTQRXXMMAAN-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50245317   
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))		BDBM50245317
PNG
(CHEMBL4102182)
Show SMILES CNS(=O)(=O)c1cccc(Nc2cc(Nc3ccc(cn3)C(F)(F)F)ncn2)c1
Show InChI InChI=1S/C17H15F3N6O2S/c1-21-29(27,28)13-4-2-3-12(7-13)25-15-8-16(24-10-23-15)26-14-6-5-11(9-22-14)17(18,19)20/h2-10,21H,1H3,(H2,22,23,24,25,26)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 16n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of mammalian ribonucleotide reductase

J Med Chem 61: 3076-3088 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00125
BindingDB Entry DOI: 10.7270/Q2Z3221C
More data for this
Ligand-Target Pair