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SMILES: Cc1nnc2nc(SCC(=O)N3CCCC3)n(-c3cccc(C)c3)c(N)c12

InChI Key: InChIKey=OJJUYHJBMRFQPT-UHFFFAOYSA-N

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

Found 1 hit for monomerid = 100032   
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))		BDBM100032
PNG
(2-[4-amino-3-methyl-5-(3-methylphenyl)pyrazolo[3,4...)
Show SMILES Cc1nnc2nc(SCC(=O)N3CCCC3)n(-c3cccc(C)c3)c(N)c12
Show InChI InChI=1S/C19H22N6OS/c1-12-6-5-7-14(10-12)25-17(20)16-13(2)22-23-18(16)21-19(25)27-11-15(26)24-8-3-4-9-24/h5-7,10H,3-4,8-9,11,20H2,1-2H3
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MMDB

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Similars
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n/an/an/an/a 1.33E+4n/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