Detailed information for compound 1882503

Basic information

Technical information
  • TDR Targets ID: 1882503
  • Name: 2-methoxybenzohydrazide
  • MW: 166.177 | Formula: C8H10N2O2
  • H donors: 2 H acceptors: 1 LogP: 0.42 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: NNC(=O)c1ccccc1OC
  • InChi: 1S/C8H10N2O2/c1-12-7-5-3-2-4-6(7)8(11)10-9/h2-5H,9H2,1H3,(H,10,11)
  • InChiKey: QMGXWNSSMGAHCA-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-Methoxybenzhydrazide
  • 2-Methoxybenzoic acid hydrazide
  • 2-Methoxybenzoyl hydrazide
  • 2-Methoxybenzoylhydrazide
  • 2-Methoxybenzoylhydrazine
  • 4-10-00-00199 (Beilstein Handbook Reference)
  • 7466-54-8
  • AIDS-166536
  • AIDS166536
  • ARONIS005823
  • Benzoic acid, 2-methoxy-, hydrazide
  • Benzoic acid, 2-methoxy-, hydrazide (9CI)
  • Benzoic acid, o-methoxy-, hydrazide
  • BRN 2208367
  • EINECS 231-260-5
  • Hydrazine, 2-methoxybenzoyl-
  • NSC 402658
  • NSC402658
  • o-ANISIC ACID, HYDRAZIDE
  • O-Anisic acid-,hydrazide
  • o-Anisohydrazide
  • o-Methoxybenzohydrazide
  • o-Methoxybenzoic acid hydrazide
  • o-Methoxybenzoylhydrazide
  • o-Methoxybenzoylhydrazine
  • o-Methoxybenzhydrazide
  • Oprea1_317212
  • STK121706
  • WLN: ZMVR BO1
  • ZINC00156105

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Capra hircus Cathepsin B Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus granulosus cathepsin b Get druggable targets OG5_127800 All targets in OG5_127800
Echinococcus granulosus cathepsin b Get druggable targets OG5_127800 All targets in OG5_127800
Giardia lamblia Cathepsin B precursor Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma mansoni cathepsin B-like peptidase (C01 family) Get druggable targets OG5_127800 All targets in OG5_127800
Leishmania donovani cysteine peptidase C (CPC) Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma mansoni cathepsin B-like peptidase (C01 family) Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma mansoni cathepsin B-like peptidase (C01 family) Get druggable targets OG5_127800 All targets in OG5_127800
Toxoplasma gondii cathepsin B Get druggable targets OG5_127800 All targets in OG5_127800
Leishmania braziliensis cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma congolense cysteine peptidase C (CPC) Get druggable targets OG5_127800 All targets in OG5_127800
Neospora caninum Cathepsin B-like protease (Precursor), related Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma congolense cysteine peptidase C (CPC) Get druggable targets OG5_127800 All targets in OG5_127800
Leishmania major cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma congolense cysteine peptidase C (CPC) Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma japonicum Cathepsin B-like cysteine proteinase precursor, putative Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma brucei cysteine peptidase C (CPC) Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma brucei gambiense cysteine peptidase C (CPC), putative,CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like, putative Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma japonicum Cathepsin B-like cysteine proteinase precursor, putative Get druggable targets OG5_127800 All targets in OG5_127800
Leishmania mexicana cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like Get druggable targets OG5_127800 All targets in OG5_127800
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma congolense cysteine peptidase C (CPC) Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma congolense cysteine peptidase C (CPC) Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma congolense cysteine peptidase C (CPC) Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma japonicum Cathepsin B-like cysteine proteinase precursor, putative Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma congolense cysteine peptidase C (CPC) Get druggable targets OG5_127800 All targets in OG5_127800
Leishmania infantum cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma congolense cysteine peptidase C (CPC) Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma congolense cysteine peptidase C (CPC) Get druggable targets OG5_127800 All targets in OG5_127800
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase Get druggable targets OG5_127800 All targets in OG5_127800
Giardia lamblia Cathepsin B precursor Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma japonicum Cathepsin B-like cysteine proteinase precursor, putative Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma japonicum Cathepsin B-like cysteine proteinase precursor, putative Get druggable targets OG5_127800 All targets in OG5_127800
Echinococcus multilocularis cathepsin b Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma mansoni SmCB2 peptidase (C01 family) Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma congolense cysteine peptidase C (CPC) Get druggable targets OG5_127800 All targets in OG5_127800
Brugia malayi cathepsin B-like cysteine proteinase Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma japonicum Cathepsin B-like cysteine proteinase precursor, putative Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma congolense cysteine peptidase C (CPC) Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma congolense cysteine peptidase C (CPC) Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma japonicum Cathepsin B-like cysteine proteinase precursor, putative Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma cruzi cysteine peptidase C (CPC), putative Get druggable targets OG5_127800 All targets in OG5_127800
Echinococcus multilocularis cathepsin b Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma japonicum ko:K01363 cathepsin B [EC3.4.22.1], putative Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma japonicum Cathepsin B-like cysteine proteinase precursor, putative Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma cruzi cysteine peptidase C (CPC), putative Get druggable targets OG5_127800 All targets in OG5_127800
Loa Loa (eye worm) cathepsin B Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma japonicum Cathepsin B-like cysteine proteinase precursor, putative Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma mansoni cathepsin B-like peptidase (C01 family) Get druggable targets OG5_127800 All targets in OG5_127800
Giardia lamblia Cathepsin B precursor Get druggable targets OG5_127800 All targets in OG5_127800
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Plasmodium berghei dipeptidyl aminopeptidase 1, putative Cathepsin B   335 aa 319 aa 25.7 %
Toxoplasma gondii cathepsin CPC2 Cathepsin B   335 aa 269 aa 25.3 %
Theileria parva cathepsin C, putative Cathepsin B   335 aa 291 aa 26.8 %
Dictyostelium discoideum cathepsin L-like proteinase Cathepsin B   335 aa 318 aa 25.5 %
Toxoplasma gondii cathepsin CPC1 Cathepsin B   335 aa 304 aa 28.6 %
Onchocerca volvulus Cathepsin B   335 aa 327 aa 35.2 %
Schistosoma japonicum ko:K01275 cathepsin C [EC3.4.14.1], putative Cathepsin B   335 aa 327 aa 30.9 %
Plasmodium berghei dipeptidyl aminopeptidase 2 Cathepsin B   335 aa 315 aa 25.1 %
Entamoeba histolytica cysteine protease, putative Cathepsin B   335 aa 276 aa 23.2 %
Plasmodium berghei berghepain-1 Cathepsin B   335 aa 286 aa 22.4 %
Babesia bovis cathepsin C precursor, putative Cathepsin B   335 aa 307 aa 24.8 %
Plasmodium knowlesi knowpain-2 Cathepsin B   335 aa 304 aa 26.0 %
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin B   335 aa 271 aa 26.9 %
Theileria parva cathepsin C, putative Cathepsin B   335 aa 282 aa 29.4 %
Plasmodium knowlesi knowpain-4 Cathepsin B   335 aa 300 aa 26.0 %
Dictyostelium discoideum cysteine protease Cathepsin B   335 aa 283 aa 25.8 %
Brugia malayi Cathepsin L-like precursor Cathepsin B   335 aa 307 aa 26.1 %
Plasmodium vivax dipeptidyl aminopeptidase 2, putative Cathepsin B   335 aa 286 aa 27.6 %
Dictyostelium discoideum hypothetical protein Cathepsin B   335 aa 290 aa 25.9 %
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin B   335 aa 270 aa 27.4 %
Giardia lamblia Hypothetical protein Cathepsin B   335 aa 273 aa 32.6 %
Plasmodium yoelii cathepsin c precursor Cathepsin B   335 aa 319 aa 25.7 %
Onchocerca volvulus Cathepsin B-like cysteine proteinase 6 homolog Cathepsin B   335 aa 315 aa 50.2 %
Toxoplasma gondii preprocathepsin c precursor, putative Cathepsin B   335 aa 274 aa 24.5 %
Plasmodium falciparum dipeptidyl aminopeptidase 1 Cathepsin B   335 aa 371 aa 25.3 %
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase Cathepsin B   335 aa 286 aa 26.9 %
Trypanosoma cruzi cysteine proteinase, putative Cathepsin B   335 aa 275 aa 25.8 %
Cryptosporidium parvum preprocathepsin c precursor, putative Cathepsin B   335 aa 281 aa 28.1 %
Dictyostelium discoideum cysteine proteinase 3 Cathepsin B   335 aa 275 aa 27.6 %
Entamoeba histolytica cysteine protease, putative Cathepsin B   335 aa 274 aa 21.5 %
Schistosoma mansoni dipeptidyl-peptidase I (C01 family) Cathepsin B   335 aa 275 aa 33.5 %
Neospora caninum hypothetical protein Cathepsin B   335 aa 306 aa 28.1 %
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin B   335 aa 308 aa 25.3 %
Plasmodium knowlesi dipeptidyl aminopeptidase 1, putative Cathepsin B   335 aa 314 aa 24.5 %
Cryptosporidium hominis preprocathepsin c precursor Cathepsin B   335 aa 278 aa 29.5 %
Giardia lamblia Cathepsin L precursor Cathepsin B   335 aa 279 aa 25.4 %
Plasmodium vivax vivapain-1 Cathepsin B   335 aa 288 aa 21.9 %
Giardia lamblia Cathepsin B-like cysteine proteinase 3 precursor Cathepsin B   335 aa 273 aa 31.9 %
Plasmodium falciparum dipeptidyl aminopeptidase 2 Cathepsin B   335 aa 302 aa 26.5 %
Plasmodium falciparum cysteine proteinase falcipain 1 Cathepsin B   335 aa 297 aa 22.9 %
Giardia lamblia Dipeptidyl-peptidase I precursor Cathepsin B   335 aa 281 aa 25.6 %
Giardia lamblia Cathepsin L precursor Cathepsin B   335 aa 280 aa 25.4 %
Plasmodium vivax vivapain-2 Cathepsin B   335 aa 309 aa 25.9 %
Plasmodium knowlesi knowpain-1 Cathepsin B   335 aa 289 aa 21.8 %
Plasmodium vivax vivapain-3 Cathepsin B   335 aa 301 aa 23.6 %
Schistosoma mansoni subfamily C1A unassigned peptidase (C01 family) Cathepsin B   335 aa 301 aa 27.6 %
Dictyostelium discoideum cysteine proteinase 1 Cathepsin B   335 aa 270 aa 25.2 %
Plasmodium vivax unspecified product Cathepsin B   335 aa 288 aa 21.9 %
Dictyostelium discoideum cysteine proteinase 5 precursor Cathepsin B   335 aa 369 aa 21.4 %
Brugia malayi Cathepsin L-like precursor Cathepsin B   335 aa 307 aa 25.7 %
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin B   335 aa 270 aa 26.7 %
Plasmodium vivax dipeptidyl aminopeptidase 1, putative Cathepsin B   335 aa 319 aa 25.1 %
Theileria parva cysteine proteinase, putative Cathepsin B   335 aa 322 aa 23.3 %
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin B   335 aa 270 aa 27.0 %
Trypanosoma cruzi cysteine proteinase, putative Cathepsin B   335 aa 278 aa 26.3 %
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin B   335 aa 297 aa 23.9 %
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin B   335 aa 271 aa 26.6 %
Schistosoma japonicum Cathepsin C precursor, putative Cathepsin B   335 aa 333 aa 26.7 %
Dictyostelium discoideum cysteine protease Cathepsin B   335 aa 285 aa 24.2 %
Plasmodium knowlesi dipeptidyl aminopeptidase 2, putative Cathepsin B   335 aa 286 aa 28.3 %
Onchocerca volvulus Cathepsin B   335 aa 313 aa 23.0 %
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin B   335 aa 273 aa 26.4 %
Giardia lamblia Cathepsin L-like protease Cathepsin B   335 aa 284 aa 23.6 %
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin B   335 aa 270 aa 27.4 %
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin B   335 aa 296 aa 23.6 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Onchocerca volvulus 0.0007 0 0.5
Onchocerca volvulus 0.0007 0 0.5
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0007 0 0.5
Echinococcus granulosus cathepsin b 0.0166 1 1
Trypanosoma brucei cysteine peptidase C (CPC) 0.0055 0.2987 0.5
Echinococcus multilocularis cathepsin b 0.0166 1 1
Giardia lamblia Cathepsin B precursor 0.0055 0.2987 0.5
Onchocerca volvulus 0.0007 0 0.5
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0166 1 1
Echinococcus granulosus cathepsin b 0.0166 1 1
Loa Loa (eye worm) hypothetical protein 0.0166 1 1
Onchocerca volvulus 0.0007 0 0.5
Onchocerca volvulus 0.0007 0 0.5
Loa Loa (eye worm) cathepsin B 0.0055 0.2987 0.2987
Onchocerca volvulus 0.0007 0 0.5
Onchocerca volvulus 0.0007 0 0.5
Onchocerca volvulus 0.0007 0 0.5
Onchocerca volvulus 0.0007 0 0.5
Giardia lamblia Cathepsin B precursor 0.0055 0.2987 0.5
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.0055 0.2987 0.5
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0166 1 1
Onchocerca volvulus 0.0007 0 0.5
Onchocerca volvulus Neuropeptide F receptor homolog 0.0007 0 0.5
Onchocerca volvulus 0.0007 0 0.5
Onchocerca volvulus 0.0007 0 0.5
Leishmania major cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like 0.0055 0.2987 0.5
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0166 1 1
Onchocerca volvulus 0.0007 0 0.5
Echinococcus multilocularis cathepsin b 0.0166 1 1
Toxoplasma gondii cathepsin B 0.0055 0.2987 0.5
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0055 0.2987 0.2987
Giardia lamblia Cathepsin B precursor 0.0055 0.2987 0.5
Onchocerca volvulus 0.0007 0 0.5
Onchocerca volvulus 0.0007 0 0.5
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.0166 1 1
Onchocerca volvulus 0.0007 0 0.5
Onchocerca volvulus 0.0007 0 0.5
Schistosoma mansoni SmCB2 peptidase (C01 family) 0.0166 1 1

Activities

Activity type Activity value Assay description Source Reference
Activity (binding) = 81.8 % Inhibition of cathepsin B in goat liver assessed as residual enzyme activity using alpha-N-benzoyl-D,L-arginine-2-naphthylamide as substrate at 0.1 x 10'-4 M pretreated with enzyme for 30 mins prior to substrate challenge by colorimetric analysis relative to control ChEMBL. 24642566
Activity (binding) = 97.83 % Inhibition of cathepsin H in goat liver assessed as residual enzyme activity using Leu-betaNA as substrate at 0.1 x 10'-4 M after 30 mins by colorimetric analysis relative to control ChEMBL. 24642566
Ki (binding) = 0.127 10'-4M Competitive inhibition of cathepsin B in goat liver using alpha-N-benzoyl-D,L-arginine-2-naphthylamide as substrate by colorimetric analysis ChEMBL. 24642566

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

No literature references available for this target.

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