Showing entry for Benzamide


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0018736
Compound NameBenzamide
Structure
FormulaC7H7NO
InchiKeyKXDAEFPNCMNJSK-UHFFFAOYSA-N
SMILESOC(=N)c1ccccc1
InchiInChI=1S/C7H7NO/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H2,8,9)
IUPACbenzamide
Molecular Weight121.05
Pubchem Id2331
Chembl IdCHEMBL267373
Targets of Information Source
DrugBank n.a
Uniport Id BXGT Id Protein Name Status Protein Class Gene Groups Target Type
Uniport Id BXGT Id Protein Name Status Protein Class Gene Groups Target Type
PDB UNU
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM Ka M-1
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM Ka M-1
P17931 BXGT008356 Galectin-3 reviewed LGALS3 Signaling - - - -
Q7DKE4 BXGT016972 Amidase unreviewed ami - - - - -
P43490 BXGT010395 Nicotinamide phosphoribosyltransferase reviewed NAMPT Signaling - - - -
P0A111 BXGT006979 Naphthalene 1,2-dioxygenase system, large oxygenase component reviewed doxB - - - - -
P62937 BXGT011471 Peptidyl-prolyl cis-trans isomerase A reviewed PPIA - - - - -
P25321 BXGT009037 cAMP-dependent protein kinase catalytic subunit alpha reviewed PRKACA - - - - -
Binding DB 50106187
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM EC50 nM
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM EC50 nM
reviewed BXGT006934 Poly [ADP-ribose] polymerase 1 reviewed PARP1 - 22000 - -
reviewed BXGT006818 Coagulation factor VII reviewed Enzyme F7 49000000 - - -
reviewed BXGT017624 Poly(ADP-ribose) glycohydrolase reviewed PARG - >1000000 - -
reviewed BXGT006934 Poly [ADP-ribose] polymerase 1 reviewed PARP1 - 5400 - -
reviewed BXGT006934 Poly [ADP-ribose] polymerase 1 reviewed PARP1 - 20000 - -
CHEMBL CHEMBL267373
Uniport Id BXGT Id Protein Name Status Protein Class Gene width="10%">Type Relation value Units
Uniport Id BXGT Id Protein Name Status Protein Class Gene Type Relation value Units
P06746 BXGT006496 DNA polymerase beta reviewed Enzyme POLB Potency '=' 79432 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency '=' 100000 nM
P0A6C1 BXGT007045 Endonuclease 4 reviewed - nfo Potency '=' 1258 nM
P09874 BXGT006934 Poly [ADP-ribose] polymerase 1 reviewed - PARP1 IC50 '=' 20000 nM
P16473 BXGT008234 Thyrotropin receptor reviewed G-protein coupled receptor TSHR Potency '=' 1258 nM
P00811 BXGT005666 Beta-lactamase reviewed - ampC Potency '=' 631 nM
P54132 BXGT011032 Bloom syndrome protein reviewed - BLM Potency '=' 2 nM
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 Potency - 25929 nM
P33261 BXGT009707 Cytochrome P450 2C19 reviewed - CYP2C19 Potency '=' 251 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency '=' 35 nM
Q9UGN5 BXGT021688 Poly [ADP-ribose] polymerase 2 reviewed - PARP2 Inhibition - - -
Q9Y6F1 BXGT022328 Protein mono-ADP-ribosyltransferase PARP3 reviewed - PARP3 Inhibition - - -
P09874 BXGT006934 Poly [ADP-ribose] polymerase 1 reviewed - PARP1 Inhibition - - -
Q01453 BXGT012588 Peripheral myelin protein 22 reviewed Cellular structure PMP22 Potency '=' 95283 nM
Q99549 BXGT019932 M-phase phosphoprotein 8 reviewed Epigenetic regulator MPHOSPH8 Potency - 39810 nM
P08684 BXGT006812 Cytochrome P450 3A4 reviewed Enzyme CYP3A4 Potency '=' 5 nM
P09874 BXGT006934 Poly [ADP-ribose] polymerase 1 reviewed - PARP1 IC50 '=' 22000 nM
P83916 BXGT012025 Chromobox protein homolog 1 reviewed Epigenetic regulator CBX1 Potency - 63095 nM
Q86W56 BXGT017624 Poly(ADP-ribose) glycohydrolase reviewed - PARG Inhibition - - -
P46063 BXGT010501 ATP-dependent DNA helicase Q1 reviewed Enzyme RECQL Potency '=' 10000 nM
Q99700 BXGT019949 Ataxin-2 reviewed Nucleic acid binding ATXN2 Potency - 3162 nM
O75496 BXGT005132 Geminin reviewed - GMNN Potency - 206 nM
P27695 BXGT009199 DNA-(apurinic or apyrimidinic site) lyase reviewed - APEX1 Potency - 891 nM
P09874 BXGT006934 Poly [ADP-ribose] polymerase 1 reviewed - PARP1 IC50 '=' 5400 nM
O75496 BXGT005132 Geminin reviewed - GMNN Potency - 6 nM
Q86W56 BXGT017624 Poly(ADP-ribose) glycohydrolase reviewed - PARG IC50 '>' 1000000 nM
P28332 BXGT009253 Alcohol dehydrogenase 6 reviewed Enzyme ADH6 log K '=' -2 -
P11766 BXGT007745 Alcohol dehydrogenase class-3 reviewed Enzyme ADH5 log K '=' -2 -
P40394 BXGT010178 Alcohol dehydrogenase class 4 mu/sigma chain reviewed Enzyme ADH7 log K '=' -2 -
P00326 BXGT005499 Alcohol dehydrogenase 1C reviewed Enzyme ADH1C log K '=' -2 -
P00325 BXGT005498 Alcohol dehydrogenase 1B reviewed Enzyme ADH1B log K '=' -2 -
P08319 BXGT006764 Alcohol dehydrogenase 4 reviewed Enzyme ADH4 log K '=' -2 -
P07327 BXGT006598 Alcohol dehydrogenase 1A reviewed Enzyme ADH1A log K '=' -2 -
Q9Y468 BXGT022270 Lethal(3)malignant brain tumor-like protein 1 reviewed Epigenetic regulator L3MBTL1 Potency '=' 223 nM
O89049 BXGT005293 Thioredoxin reductase 1, cytoplasmic reviewed - Txnrd1 Potency - 5972 nM
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT Potency '=' 3162 nM
P15289 BXGT008102 Arylsulfatase A reviewed Enzyme ARSA Potency - 1694 nM
Q99714 BXGT019954 3-hydroxyacyl-CoA dehydrogenase type-2 reviewed Enzyme HSD17B10 Potency '=' 39810 nM
P13726 BXGT007950 Tissue factor reviewed Receptor F3 Ki '=' 49000000 nM
P08709 BXGT006818 Coagulation factor VII reviewed Enzyme F7 Ki '=' 49000000 nM
P09874 BXGT006934 Poly [ADP-ribose] polymerase 1 reviewed - PARP1 Inhibition '=' 59 %
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00950 Aconitum vilmorini Aconitum vilmorini Others
BXGF01823 Houttuynia cordata Houttuynia cordata Medicinal Plant
BXGF06283 Mortonia palmeri Mortonia palmeri Others
The  compound-realted  diseases
Diseases
BXGD Id Disease Name CUI Disease Id Disease Class Name Number of targets?Number of targets related to compound connecting disease, higher numbers indicate the compound is more associated with the disease