BDBM32672 MLS000097371::N-[4-(1H-1,2,3-benzotriazol-1-ylcarbonyl)phenyl]butanamide::N-[4-(benzotriazol-1-ylcarbonyl)phenyl]butanamide::N-[4-(benzotriazole-1-carbonyl)phenyl]butanamide::N-[4-(benzotriazole-1-carbonyl)phenyl]butyramide::N-[4-[1-benzotriazolyl(oxo)methyl]phenyl]butanamide::SMR000076008::cid_2201551

SMILES CCCC(=O)Nc1ccc(cc1)C(=O)n1nnc2ccccc12

InChI Key InChIKey=VUWARVVMIAAMOY-UHFFFAOYSA-N

Data  8 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 32672   

TargetCoagulation factor XII(Homo sapiens (Human))
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM32672(MLS000097371 | N-[4-(1H-1,2,3-benzotriazol-1-ylcar...)
Affinity DataIC50:  7.10E+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
TargetCoagulation factor XI(Homo sapiens (Human))
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM32672(MLS000097371 | N-[4-(1H-1,2,3-benzotriazol-1-ylcar...)
Affinity DataIC50:  248nMpH: 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 XI(Homo sapiens (Human))
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM32672(MLS000097371 | N-[4-(1H-1,2,3-benzotriazol-1-ylcar...)
Affinity DataIC50:  248nMpH: 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))
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM32672(MLS000097371 | N-[4-(1H-1,2,3-benzotriazol-1-ylcar...)
Affinity DataIC50:  7.10E+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
TargetComplement C1s subcomponent(Homo sapiens (Human))
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM32672(MLS000097371 | N-[4-(1H-1,2,3-benzotriazol-1-ylcar...)
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 Pennsyl...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetCathepsin G(Homo sapiens (Human))
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM32672(MLS000097371 | N-[4-(1H-1,2,3-benzotriazol-1-ylcar...)
Affinity DataIC50:  923nMAssay Description:Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetCoagulation factor XI(Homo sapiens (Human))
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM32672(MLS000097371 | N-[4-(1H-1,2,3-benzotriazol-1-ylcar...)
Affinity DataIC50:  248nMAssay 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
TargetComplement C1s subcomponent(Homo sapiens (Human))
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM32672(MLS000097371 | N-[4-(1H-1,2,3-benzotriazol-1-ylcar...)
Affinity DataIC50:  380nMAssay Description:Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Dr. Scott L. Diamond, University of Pen...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay