BDBM50106187 Benzenecarboxamide::Benzoic acid amide::Benzoylamide::CHEMBL267373::Phenylcarboxamide::Phenylcarboxyamide::benzamide

SMILES NC(=O)c1ccccc1

InChI Key InChIKey=KXDAEFPNCMNJSK-UHFFFAOYSA-N

Data  3 KI  4 IC50  1 ITC

PDB links: 9 PDB IDs match this monomer.

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50106187   

TargetNicotinamide N-methyltransferase(Homo sapiens (Human))
TBA

Curated by ChEMBL
LigandPNGBDBM50106187(Benzenecarboxamide | Benzoic acid amide | Benzoyla...)
Affinity DataKi: >1.00E+5nMAssay Description:Inhibition of full-length human N-terminal TEV cleavage site NNMT (1 to 270 residues) expressed in Escherichia coli BL21-CodonPlus(DE3)-RIPL cells us...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCoagulation factor VII/Tissue factor(Homo sapiens (Human))
Bristol-Myers Squibb

Curated by ChEMBL
LigandPNGBDBM50106187(Benzenecarboxamide | Benzoic acid amide | Benzoyla...)
Affinity DataKi:  4.90E+7nMAssay Description:Inhibition of human soluble tissue factor/factor VIIa expressed in Origami B (DE3) using D-Ile-Pro-Arg-pNA as substrate after 30 mins by spectrophoto...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCoagulation factor VII/Tissue factor(Homo sapiens (Human))
Bristol-Myers Squibb

Curated by ChEMBL
LigandPNGBDBM50106187(Benzenecarboxamide | Benzoic acid amide | Benzoyla...)
Affinity DataKi:  4.90E+7nMAssay Description:Inhibition of recombinant human factor-7a/TF using S2288 as substrate measured after 60 minsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

Activity Spreadsheet -- ITC Data from BindingDB

Found 1 hit for monomerid = 50106187   

HostPNGBDBM36284(BDBM36303 | BDBM36310 | Methyl Viologen-Cucurbit[8...)
University of Cambridge

GuestPNGBDBM50106187(Benzenecarboxamide | Benzoic acid amide | Benzoyla...)
ITC DataΔG°: -5.63kcal/mole logk: 1.30E+4
pH: 7.0 T: 25.00°C