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SMILES: CC(c1nc2ccccc2[nH]1)n1c2ccccc2nc(-c2cccs2)c1=O

InChI Key: InChIKey=VLQIPFLGKYPKHQ-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 = 100191   
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
Kallikrein-7


(Homo sapiens (Human))		BDBM100191
PNG
(1-[1-(1H-benzimidazol-2-yl)ethyl]-3-(2-thienyl)qui...)
Show SMILES CC(c1nc2ccccc2[nH]1)n1c2ccccc2nc(-c2cccs2)c1=O
Show InChI InChI=1S/C21H16N4OS/c1-13(20-23-14-7-2-3-8-15(14)24-20)25-17-10-5-4-9-16(17)22-19(21(25)26)18-11-6-12-27-18/h2-13H,1H3,(H,23,24)
PDB
MMDB

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n/an/an/an/a 8.14E+3n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q29G5KF0
More data for this
Ligand-Target Pair