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SMILES: NS(=O)(=O)c1cccc(c1)-c1n[nH]c2ccc(NS(=O)(=O)c3cccs3)cc12

InChI Key: InChIKey=BACIJVCILOSSEY-UHFFFAOYSA-N

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50053330   
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
Dual specificity protein kinase TTK


(Homo sapiens (Human))		BDBM50053330
PNG
(CHEMBL3330257)
Show SMILES NS(=O)(=O)c1cccc(c1)-c1n[nH]c2ccc(NS(=O)(=O)c3cccs3)cc12
Show InChI InChI=1S/C17H14N4O4S3/c18-27(22,23)13-4-1-3-11(9-13)17-14-10-12(6-7-15(14)19-20-17)21-28(24,25)16-5-2-8-26-16/h1-10,21H,(H,19,20)(H2,18,22,23)
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KEGG

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Article
PubMed
n/an/a 340n/an/an/an/an/an/a



University Health Network

Curated by ChEMBL


Assay Description
Inhibition of SUMO-tagged human TTK (1-275 residues) compound pre-incubated for 15 mins prior ATP addition by MBP-based assay

Bioorg Med Chem 22: 4968-97 (2014)


Article DOI: 10.1016/j.bmc.2014.06.027
BindingDB Entry DOI: 10.7270/Q2K35WB2
More data for this
Ligand-Target Pair