BDBM33433 1-[(5-methyl-3-phenyl-4-isoxazolyl)carbonyl]-1H-1,2,3-benzotriazole::1-benzotriazolyl-(5-methyl-3-phenyl-4-isoxazolyl)methanone::MLS000099557::SMR000071313::benzotriazol-1-yl-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanone::benzotriazol-1-yl-(5-methyl-3-phenyl-isoxazol-4-yl)methanone::cid_1121978

SMILES Cc1onc(c1C(=O)n1nnc2ccccc12)-c1ccccc1

InChI Key InChIKey=XWEWIQCAIBLPHV-UHFFFAOYSA-N

Data  2 IC50  2 EC50

  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 = 33433   

TargetCoagulation factor XII(Homo sapiens (Human))
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM33433(1-[(5-methyl-3-phenyl-4-isoxazolyl)carbonyl]-1H-1,...)
Affinity DataIC50:  3.97E+3nMpH: 7.4 T: 2°CAssay Description:HTS was performed on a total of 33,068 compounds of the MLSCN library, 23,017 of which were not in the mixture HTS plates used previously. These comp...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetProtein RecA(Mycobacterium tuberculosis H37Rv)
Broad Institute

Curated by PubChem BioAssay
LigandPNGBDBM33433(1-[(5-methyl-3-phenyl-4-isoxazolyl)carbonyl]-1H-1,...)
Affinity DataEC50:  1.30E+4nMAssay Description:Keywords: GFP-RecA intein, protein splicing, refolding, reducing reagent, GFP fluorescence Assay Overview: M. tuberculosis harbors three inteins, whi...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetProtein RecA(Mycobacterium tuberculosis H37Rv)
Broad Institute

Curated by PubChem BioAssay
LigandPNGBDBM33433(1-[(5-methyl-3-phenyl-4-isoxazolyl)carbonyl]-1H-1,...)
Affinity DataEC50:  3.54E+4nMAssay Description:Keywords: GFP, refolding, reducing reagent, GFP fluorescence Assay Overview: M. tuberculosis harbors three inteins, which interrupt the DnaB, RecA, a...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetCoagulation factor XII(Homo sapiens (Human))
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM33433(1-[(5-methyl-3-phenyl-4-isoxazolyl)carbonyl]-1H-1,...)
Affinity DataIC50:  3.97E+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