BDBM45545 1-(4-methylphenyl)-4-[(4-methylphenyl)methylsulfanyl]pyrazolo[3,4-d]pyrimidine::1-(4-methylphenyl)-4-[(4-methylphenyl)methylthio]pyrazolo[3,4-d]pyrimidine::4-(4-Methyl-benzylsulfanyl)-1-p-tolyl-1H-pyrazolo[3,4-d]pyrimidine::4-[(4-methylbenzyl)thio]-1-(p-tolyl)pyrazolo[3,4-d]pyrimidine::MLS000580246::SMR000220513::cid_1997013

SMILES Cc1ccc(CSc2ncnc3n(ncc23)-c2ccc(C)cc2)cc1

InChI Key InChIKey=FMOWRWARZPTVDZ-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 45545   

TargetKallikrein-5(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 45545BDBM45545(MLS000580246 | 1-(4-methylphenyl)-4-[(4-methylphen...)
Affinity DataIC50: 5.00E+4nMAssay Description:Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/8/2011
Entry Details
PCBioAssay
TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 45545BDBM45545(MLS000580246 | 1-(4-methylphenyl)-4-[(4-methylphen...)
Affinity DataIC50: 5.00E+4nMAssay Description:Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/27/2011
Entry Details
PCBioAssay