BDBM32806 1-benzotriazolyl-(3,4-dimethoxyphenyl)methanone::MLS000392028::SMR000102548::benzotriazol-1-yl-(3,4-dimethoxyphenyl)methanone::cid_743706

SMILES COc1ccc(cc1OC)C(=O)n1nnc2ccccc12

InChI Key InChIKey=GCEWJBIDLIIRAB-UHFFFAOYSA-N

Data  4 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 32806   

TargetCoagulation factor XI(Homo sapiens (Human))
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM32806(1-benzotriazolyl-(3,4-dimethoxyphenyl)methanone | ...)
Affinity DataIC50:  474nMpH: 7.4 T: 2°CAssay Description:Factor XIa (0.23 ug/mL) was incubated with Boc-Glu-Ala-Arg-AMC substrate (15 uM) in 10 uL of assay buffer for 2 hr at room temperature. Read fluoresc...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetCoagulation factor XII(Homo sapiens (Human))
The University Of Akron

Curated by ChEMBL
LigandPNGBDBM32806(1-benzotriazolyl-(3,4-dimethoxyphenyl)methanone | ...)
Affinity DataIC50:  2.67E+4nMAssay Description:Inhibition of human factor 12a using Boc-Gly-Gln-Arg-AMC substrate incubated for 1 hr by fluorescence assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetKallikrein-5(Homo sapiens (Human))
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM32806(1-benzotriazolyl-(3,4-dimethoxyphenyl)methanone | ...)
Affinity DataIC50:  1.44E+3nMAssay 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 DepthDetails PCBioAssay
TargetCoagulation factor XII(Homo sapiens (Human))
The University Of Akron

Curated by ChEMBL
LigandPNGBDBM32806(1-benzotriazolyl-(3,4-dimethoxyphenyl)methanone | ...)
Affinity DataIC50:  755nMAssay 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 DepthDetails PCBioAssay