Detailed information for compound 1439652

Basic information

Technical information
  • TDR Targets ID: 1439652
  • Name: 1-methylsulfonyl-5-[1-(phenoxy)ethyl]pyrazole
  • MW: 266.316 | Formula: C12H14N2O3S
  • H donors: 0 H acceptors: 3 LogP: 1.81 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(c1ccnn1S(=O)(=O)C)Oc1ccccc1
  • InChi: 1S/C12H14N2O3S/c1-10(17-11-6-4-3-5-7-11)12-8-9-13-14(12)18(2,15)16/h3-10H,1-2H3
  • InChiKey: VXFYKJIHKOLIIH-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 1-mesyl-5-[1-(phenoxy)ethyl]pyrazole
  • Oprea1_833979
  • 10C-007
  • 1-(methylsulfonyl)-5-(1-phenoxyethyl)-1H-pyrazole
  • MLS000594332
  • SMR000126512
  • Bionet2_001514

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens glycoprotein hormones, alpha polypeptide Starlite/ChEMBL No references
Rattus norvegicus Inositol monophosphatase 1 Starlite/ChEMBL No references
Homo sapiens euchromatic histone-lysine N-methyltransferase 2 Starlite/ChEMBL No references
Homo sapiens GNAS complex locus Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Loa Loa (eye worm) pre-SET domain-containing protein family protein Get druggable targets OG5_131470 All targets in OG5_131470
Trichomonas vaginalis myo inositol monophosphatase, putative Get druggable targets OG5_126810 All targets in OG5_126810
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis inositol monophosphatase 1 Get druggable targets OG5_126810 All targets in OG5_126810
Leishmania mexicana myo-inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Brugia malayi Pre-SET motif family protein Get druggable targets OG5_131470 All targets in OG5_131470
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Trichomonas vaginalis inositol monophosphatase, putative Get druggable targets OG5_126810 All targets in OG5_126810
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus granulosus inositol monophosphatase 1 Get druggable targets OG5_126810 All targets in OG5_126810
Entamoeba histolytica myo-inositol monophosphatase, putative Get druggable targets OG5_126810 All targets in OG5_126810
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative Get druggable targets OG5_131088 All targets in OG5_131088
Onchocerca volvulus Get druggable targets OG5_131470 All targets in OG5_131470
Leishmania braziliensis myo-inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Schistosoma mansoni inositol monophosphatase Get druggable targets OG5_126810 All targets in OG5_126810
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Mycobacterium ulcerans extragenic suppressor protein SuhB Get druggable targets OG5_126810 All targets in OG5_126810
Brugia malayi Inositol-1 Get druggable targets OG5_126810 All targets in OG5_126810
Trypanosoma congolense inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative Get druggable targets OG5_131088 All targets in OG5_131088
Trypanosoma brucei gambiense inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). Get druggable targets OG5_126810 All targets in OG5_126810
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase Get druggable targets OG5_126810 All targets in OG5_126810
Neospora caninum hypothetical protein Get druggable targets OG5_126810 All targets in OG5_126810
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Loa Loa (eye worm) inositol-1 Get druggable targets OG5_126810 All targets in OG5_126810
Trichomonas vaginalis myo inositol monophosphatase, putative Get druggable targets OG5_126810 All targets in OG5_126810
Leishmania infantum myo-inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Schistosoma mansoni inositol monophosphatase Get druggable targets OG5_126810 All targets in OG5_126810
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative Get druggable targets OG5_126810 All targets in OG5_126810
Leishmania donovani myo-inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Trichomonas vaginalis set domain proteins, putative Get druggable targets OG5_131470 All targets in OG5_131470
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain Get druggable targets OG5_131088 All targets in OG5_131088
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB Get druggable targets OG5_126810 All targets in OG5_126810
Schistosoma japonicum ko:K01092 myo-inositol-1(or 4)-monophosphatase [EC3.1.3.25], putative Get druggable targets OG5_126810 All targets in OG5_126810
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Loa Loa (eye worm) hypothetical protein Inositol monophosphatase 1   277 aa 298 aa 23.8 %
Trypanosoma cruzi inositol polyphosphate 1-phosphatase, putative Inositol monophosphatase 1   277 aa 291 aa 23.7 %
Onchocerca volvulus Inositol monophosphatase 1   277 aa 238 aa 22.7 %
Trypanosoma congolense inositol-1(or 4)-monophosphatase, putative Inositol monophosphatase 1   277 aa 304 aa 28.9 %
Dictyostelium discoideum 3',5'-bisphosphate nucleotidase Inositol monophosphatase 1   277 aa 230 aa 25.2 %
Onchocerca volvulus Putative trans-2-enoyl-CoA reductase 1, mitochondrial Inositol monophosphatase 1   277 aa 278 aa 23.0 %
Entamoeba histolytica 3(2),5-bisphosphate nucleotidase, putative Inositol monophosphatase 1   277 aa 287 aa 22.3 %
Dictyostelium discoideum 3',5'-bisphosphate nucleotidase 1 Inositol monophosphatase 1   277 aa 275 aa 22.2 %
Brugia malayi Inositol monophosphatase family protein Inositol monophosphatase 1   277 aa 238 aa 21.8 %
Trypanosoma brucei gambiense inositol-1(or 4)-monophosphatase, putative Inositol monophosphatase 1   277 aa 309 aa 27.8 %
Entamoeba histolytica 3(2),5-bisphosphate nucleotidase, putative Inositol monophosphatase 1   277 aa 263 aa 24.0 %
Toxoplasma gondii intraflagellar transport protein 172, putative glycoprotein hormones, alpha polypeptide 116 aa 94 aa 26.6 %
Candida albicans one of two closely related genes similar to S. cerevisiae MET22/HAL2 (YOL064C) bisphosphate-3'-nucleotidase, implicated in salt Inositol monophosphatase 1   277 aa 306 aa 22.5 %
Trypanosoma brucei inositol-1(or 4)-monophosphatase, putative Inositol monophosphatase 1   277 aa 304 aa 27.3 %
Trypanosoma cruzi myo-inositol-1 phosphatase, putative Inositol monophosphatase 1   277 aa 284 aa 30.6 %
Schistosoma japonicum ko:K01082 3'(2'), 5'-bisphosphate nucleotidase [EC3.1.3.7], putative Inositol monophosphatase 1   277 aa 275 aa 21.5 %
Candida albicans one of two closely related genes similar to S. cerevisiae MET22/HAL2 (YOL064C) bisphosphate-3'-nucleotidase, implicated in salt Inositol monophosphatase 1   277 aa 300 aa 22.0 %
Trichomonas vaginalis inositol monophosphatase, putative Inositol monophosphatase 1   277 aa 268 aa 22.4 %
Trichomonas vaginalis myo inositol monophosphatase, putative Inositol monophosphatase 1   277 aa 276 aa 21.4 %
Trichomonas vaginalis inositol monophosphatase, putative Inositol monophosphatase 1   277 aa 258 aa 21.7 %
Trichomonas vaginalis diphosphonucleoside phosphohydrolase, putative Inositol monophosphatase 1   277 aa 263 aa 21.7 %
Schistosoma mansoni GTP-binding protein alpha subunit gna GNAS complex locus 394 aa 450 aa 28.7 %
Onchocerca volvulus Putative 28S ribosomal protein S10, mitochondrial Inositol monophosphatase 1   277 aa 271 aa 46.1 %
Candida albicans one of two closely related genes similar to S. cerevisiae MET22/HAL2 (YOL064C) bisphosphate-3'-nucleotidase, implicated in salt Inositol monophosphatase 1   277 aa 307 aa 22.5 %
Schistosoma mansoni pap-inositol-14-phosphatase Inositol monophosphatase 1   277 aa 279 aa 22.9 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.0257 0.018
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0432 0.6594 1
Trypanosoma cruzi cysteine peptidase, putative 0.0432 0.6594 0.6567
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.004 0 0.5
Entamoeba histolytica cysteine protease, putative 0.0432 0.6594 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0432 0.6594 1
Entamoeba histolytica papain family cysteine protease domain containing protein 0.0093 0.0899 0.126
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0635 1 1
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0093 0.0899 0.0827
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0432 0.6594 1
Giardia lamblia Cathepsin B precursor 0.0261 0.3714 1
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0432 0.6594 0.6567
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0432 0.6594 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0257 0.018
Brugia malayi cathepsin L-like cysteine proteinase, identical 0.0137 0.1638 0.1571
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0231 0.3208 0.3154
Leishmania major cathepsin L-like protease 0.0432 0.6594 1
Entamoeba histolytica cysteine protease, putative 0.0231 0.3208 0.4803
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0257 0.018
Leishmania major cathepsin L-like protease 0.0432 0.6594 1
Entamoeba histolytica cysteine proteinase, putative 0.0231 0.3208 0.4803
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0231 0.3208 0.4803
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0432 0.6594 1
Trichomonas vaginalis Clan CA, family C1, cathepsin F-like cysteine peptidase 0.0093 0.0899 0.126
Brugia malayi Cathepsin L-like precursor 0.0432 0.6594 0.6567
Echinococcus granulosus cathepsin l cysteine peptidase 0.0432 0.6594 0.6567
Entamoeba histolytica cysteine protease, putative 0.0093 0.0899 0.126
Plasmodium vivax vivapain-1 0.0231 0.3208 0.4054
Brugia malayi Cathepsin L-like precursor 0.0432 0.6594 0.6567
Onchocerca volvulus 0.0432 0.6594 1
Brugia malayi cathepsin F-like cysteine proteinase 0.0093 0.0899 0.0827
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0257 0.018
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0432 0.6594 1
Brugia malayi Cathepsin L-like precursor 0.0432 0.6594 0.6567
Echinococcus multilocularis cathepsin b 0.0635 1 1
Entamoeba histolytica cysteine protease, putative 0.0093 0.0899 0.126
Schistosoma mansoni cathepsin F (C01 family) 0.0432 0.6594 0.6567
Entamoeba histolytica cysteine protease, putative 0.0231 0.3208 0.4803
Entamoeba histolytica cysteine protease, putative 0.0231 0.3208 0.4803
Trypanosoma cruzi cysteine protease, putative 0.0231 0.3208 0.3154
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.0093 0.0899 0.126
Onchocerca volvulus 0.0432 0.6594 1
Onchocerca volvulus 0.0432 0.6594 1
Loa Loa (eye worm) hypothetical protein 0.0137 0.1638 0.1571
Entamoeba histolytica cysteine protease, putative 0.0231 0.3208 0.4803
Entamoeba histolytica cysteine protease, putative 0.0231 0.3208 0.4803
Loa Loa (eye worm) hypothetical protein 0.0093 0.0899 0.0827
Echinococcus multilocularis cysteine protease 0.0432 0.6594 0.6567
Entamoeba histolytica cysteine protease, putative 0.0231 0.3208 0.4803
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0432 0.6594 0.6567
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0432 0.6594 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0093 0.0899 0.126
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0045 0.0079 0.5
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0295 0.4285 0.6457
Schistosoma mansoni cathepsin F (C01 family) 0.0432 0.6594 0.6567
Loa Loa (eye worm) hypothetical protein 0.0093 0.0899 0.0827
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0432 0.6594 1
Schistosoma mansoni dipeptidyl-peptidase I (C01 family) 0.0093 0.0899 0.0827
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0231 0.3208 0.3154
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0432 0.6594 1
Trypanosoma cruzi major cysteine proteinase, putative 0.0093 0.0899 0.0827
Brugia malayi Cathepsin L-like precursor 0.0137 0.1638 0.1571
Leishmania major cathepsin L-like protease 0.0432 0.6594 1
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.0635 1 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0093 0.0899 0.126
Brugia malayi cathepsin F-like cysteine proteinase 0.0137 0.1638 0.1571
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0257 0.018
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.0093 0.0899 0.126
Brugia malayi Cathepsin L-like precursor 0.0432 0.6594 0.6567
Loa Loa (eye worm) hypothetical protein 0.0295 0.4285 0.424
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0432 0.6594 1
Plasmodium vivax unspecified product 0.0137 0.1638 0.1297
Schistosoma mansoni cathepsin F (C01 family) 0.0295 0.4285 0.424
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0257 0.018
Trypanosoma cruzi cysteine peptidase (N-terminal), putative 0.0231 0.3208 0.3154
Echinococcus multilocularis cathepsin L 0.0231 0.3208 0.3154
Trypanosoma cruzi cysteine peptidase, putative 0.0432 0.6594 0.6567
Leishmania major cathepsin L-like protease 0.0432 0.6594 1
Onchocerca volvulus 0.0286 0.4136 0.5684
Brugia malayi Cathepsin L-like cysteine proteinase 0.0295 0.4285 0.424
Brugia malayi Pre-SET motif family protein 0.0251 0.3553 0.3502
Brugia malayi Cathepsin L-like precursor 0.0432 0.6594 0.6567
Echinococcus multilocularis cathepsin L cysteine protease 0.0432 0.6594 0.6567
Loa Loa (eye worm) hypothetical protein 0.0093 0.0899 0.0827
Trichomonas vaginalis Clan CA, family C1, cathepsin L, S or H-like cysteine peptidase 0.0093 0.0899 0.126
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0093 0.0899 0.126
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0295 0.4285 0.6457
Brugia malayi Papain family cysteine protease containing protein 0.0093 0.0899 0.0827
Entamoeba histolytica cysteine protease, putative 0.0231 0.3208 0.4803
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0231 0.3208 0.4803
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.0093 0.0899 0.126
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0093 0.0899 0.126
Brugia malayi cahepsin L-like non-peptiedase homolog 0.0093 0.0899 0.0827
Onchocerca volvulus 0.0295 0.4285 0.5946
Schistosoma mansoni SmCB2 peptidase (C01 family) 0.0635 1 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0257 0.018
Toxoplasma gondii cathepsin CPL 0.0432 0.6594 1
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0093 0.0899 0.0827
Entamoeba histolytica hypothetical protein 0.0093 0.0899 0.126
Trypanosoma cruzi cysteine proteinase, putative 0.0231 0.3208 0.3154
Brugia malayi Papain family cysteine protease containing protein 0.0432 0.6594 0.6567
Entamoeba histolytica cysteine protease, putative 0.0231 0.3208 0.4803
Leishmania major cathepsin L-like protease 0.0432 0.6594 1
Brugia malayi cathepsin L precursor 0.0093 0.0899 0.0827
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0432 0.6594 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0432 0.6594 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0432 0.6594 1
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0093 0.0899 0.0827
Entamoeba histolytica papain family cysteine protease domain containing protein 0.0093 0.0899 0.126
Leishmania major cathepsin L-like protease 0.0432 0.6594 1
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0635 1 1
Toxoplasma gondii cathepsin CPC2 0.0093 0.0899 0.126
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0231 0.3208 0.4803
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0432 0.6594 1
Brugia malayi Papain family cysteine protease containing protein 0.0093 0.0899 0.0827
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0432 0.6594 1
Brugia malayi Cathepsin L-like precursor 0.0295 0.4285 0.424
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0432 0.6594 1
Echinococcus granulosus cathepsin L cysteine protease 0.0231 0.3208 0.3154
Entamoeba histolytica cysteine proteinase 2 0.0231 0.3208 0.4803
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0045 0.0079 0.5
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0432 0.6594 1
Toxoplasma gondii cathepsin B 0.0261 0.3714 0.558
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0432 0.6594 1
Brugia malayi cathepsin L-like precursor 0.0295 0.4285 0.424
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0093 0.0899 0.0827
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0093 0.0899 0.0827
Onchocerca volvulus Cathepsin L homolog 0.0432 0.6594 1
Loa Loa (eye worm) cathepsin B 0.0261 0.3714 0.3664
Onchocerca volvulus 0.0432 0.6594 1
Onchocerca volvulus 0.0432 0.6594 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0432 0.6594 1
Loa Loa (eye worm) cysteine protease 0.0432 0.6594 0.6567
Trypanosoma brucei cysteine peptidase C (CPC) 0.0261 0.3714 0.558
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.0261 0.3714 0.558
Toxoplasma gondii cathepsin CPC1 0.0093 0.0899 0.126
Loa Loa (eye worm) hypothetical protein 0.0137 0.1638 0.1571
Entamoeba histolytica cysteine protease, putative 0.0231 0.3208 0.4803
Schistosoma mansoni cathepsin s 0.0137 0.1638 0.1571
Brugia malayi Cathepsin L-like precursor 0.0432 0.6594 0.6567
Trypanosoma cruzi cruzipain precursor, putative 0.0432 0.6594 0.6567
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0137 0.1638 0.1571
Entamoeba histolytica cysteine proteinase, putative 0.0231 0.3208 0.4803
Echinococcus granulosus cathepsin b 0.0635 1 1
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0251 0.3553 0.3502
Trypanosoma cruzi cysteine proteinase, putative 0.0231 0.3208 0.3154
Trypanosoma cruzi cysteine peptidase, putative 0.0432 0.6594 0.6567
Leishmania major cysteine peptidase A (CPA) 0.0432 0.6594 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0432 0.6594 1
Entamoeba histolytica cysteine protease, putative 0.0093 0.0899 0.126
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0432 0.6594 1
Schistosoma mansoni cathepsin B (C01 family) 0.0093 0.0899 0.0827
Entamoeba histolytica cysteine protease, putative 0.0093 0.0899 0.126
Echinococcus multilocularis cathepsin b 0.0635 1 1
Echinococcus granulosus cathepsin l1 0.0432 0.6594 0.6567
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0432 0.6594 1
Echinococcus granulosus cathepsin b 0.0635 1 1
Brugia malayi Papain family cysteine protease containing protein 0.0231 0.3208 0.3154
Echinococcus granulosus cysteine protease 0.0231 0.3208 0.3154
Echinococcus multilocularis cathepsin L 0.0093 0.0899 0.0827
Loa Loa (eye worm) hypothetical protein 0.0137 0.1638 0.1571
Entamoeba histolytica cysteine proteinase, putative 0.0231 0.3208 0.4803
Loa Loa (eye worm) cysteine proteinase cathepsin Z 0.0093 0.0899 0.0827
Giardia lamblia Cathepsin B precursor 0.0261 0.3714 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0093 0.0899 0.126
Echinococcus multilocularis cysteine protease 0.0432 0.6594 0.6567
Entamoeba histolytica cysteine proteinase, putative 0.0231 0.3208 0.4803
Onchocerca volvulus 0.0432 0.6594 1
Toxoplasma gondii preprocathepsin c precursor, putative 0.0093 0.0899 0.126
Loa Loa (eye worm) hypothetical protein 0.0295 0.4285 0.424
Trichomonas vaginalis Clan CA, family C1, cathepsin H-like cysteine peptidase 0.0093 0.0899 0.126
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0432 0.6594 0.6567
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.0261 0.3714 0.3664
Onchocerca volvulus 0.0432 0.6594 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0432 0.6594 1
Entamoeba histolytica cysteine proteinase, putative 0.0432 0.6594 1
Trypanosoma cruzi cysteine peptidase, putative 0.0137 0.1638 0.1571
Trichomonas vaginalis conserved hypothetical protein 0.0093 0.0899 0.126
Loa Loa (eye worm) hypothetical protein 0.0635 1 1
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0432 0.6594 0.6567
Plasmodium falciparum cysteine proteinase falcipain 3 0.0432 0.6594 1
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0093 0.0899 0.0827
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0432 0.6594 1
Trypanosoma cruzi cysteine peptidase, putative 0.0432 0.6594 0.6567
Brugia malayi cathepsin Z-like cysteine proteinase 0.0093 0.0899 0.0827
Brugia malayi cathepsin L-like cysteine proteinase 0.0093 0.0899 0.0827
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0231 0.3208 0.4803
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0093 0.0899 0.0827
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0432 0.6594 1
Leishmania major cathepsin L-like protease 0.0432 0.6594 1
Schistosoma mansoni subfamily C1A unassigned peptidase (C01 family) 0.0093 0.0899 0.0827
Loa Loa (eye worm) fibroinase 0.0432 0.6594 0.6567
Plasmodium vivax unspecified product 0.0231 0.3208 0.4054
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0257 0.018
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0093 0.0899 0.126
Entamoeba histolytica cysteine protease, putative 0.0093 0.0899 0.126
Loa Loa (eye worm) ctsf protein 0.0432 0.6594 0.6567
Leishmania major cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like 0.0261 0.3714 0.558
Entamoeba histolytica cysteine proteinase, putative 0.0295 0.4285 0.6457
Trypanosoma cruzi major cysteine proteinase, putative 0.0093 0.0899 0.0827
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0432 0.6594 1
Entamoeba histolytica cysteine protease, putative 0.0231 0.3208 0.4803
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0432 0.6594 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0432 0.6594 1
Onchocerca volvulus Cathepsin L homolog 0.0432 0.6594 1
Onchocerca volvulus Cathepsin F homolog 0.0432 0.6594 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0432 0.6594 1
Schistosoma mansoni cathepsin C 0.0093 0.0899 0.0827
Trichomonas vaginalis conserved hypothetical protein 0.0093 0.0899 0.126
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.0093 0.0899 0.126
Loa Loa (eye worm) hypothetical protein 0.0295 0.4285 0.424
Brugia malayi Papain family cysteine protease containing protein 0.0231 0.3208 0.3154
Entamoeba histolytica cysteine protease, putative 0.0231 0.3208 0.4803
Entamoeba histolytica cysteine proteinase 1, putative 0.0231 0.3208 0.4803
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0093 0.0899 0.126
Loa Loa (eye worm) hypothetical protein 0.0093 0.0899 0.0827
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0432 0.6594 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L or H-like cysteine peptidase 0.0093 0.0899 0.126
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0231 0.3208 0.3154
Trypanosoma cruzi cruzipain precursor, putative 0.0137 0.1638 0.1571
Entamoeba histolytica cysteine proteinase, putative 0.0432 0.6594 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0432 0.6594 1
Schistosoma mansoni cathepsin S (C01 family) 0.0093 0.0899 0.0827
Trichomonas vaginalis set domain proteins, putative 0.0286 0.4136 0.6228
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0295 0.4285 0.424
Giardia lamblia Cathepsin B precursor 0.0261 0.3714 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0093 0.0899 0.126
Echinococcus granulosus cathepsin L cysteine proteinase 0.0432 0.6594 0.6567
Brugia malayi Papain family cysteine protease containing protein 0.0093 0.0899 0.0827
Loa Loa (eye worm) hypothetical protein 0.0432 0.6594 0.6567
Schistosoma mansoni subfamily C1A unassigned peptidase (C01 family) 0.0093 0.0899 0.0827
Echinococcus granulosus cathepsin l1 0.0295 0.4285 0.424
Echinococcus granulosus cathepsin L 0.0231 0.3208 0.3154
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0093 0.0899 0.126
Echinococcus multilocularis cathepsin L cysteine protease 0.0432 0.6594 0.6567
Entamoeba histolytica cysteine protease, putative 0.0093 0.0899 0.126
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0432 0.6594 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.0257 0.018
Plasmodium falciparum cysteine proteinase falcipain 1 0.0231 0.3208 0.4054
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.004 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0093 0.0899 0.0827
Loa Loa (eye worm) hypothetical protein 0.0093 0.0899 0.0827
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0432 0.6594 1
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0635 1 1
Plasmodium vivax vivapain-2 0.0432 0.6594 1
Entamoeba histolytica cysteine protease, putative 0.0231 0.3208 0.4803
Plasmodium vivax vivapain-2 0.0432 0.6594 1
Brugia malayi fibroinase precursor 0.0093 0.0899 0.0827
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0432 0.6594 1
Brugia malayi cathepsin Z-like cysteine proteinase 0.0093 0.0899 0.0827
Echinococcus granulosus cathepsin L 0.0093 0.0899 0.0827
Leishmania major cathepsin L-like protease 0.0432 0.6594 1
Trypanosoma cruzi cysteine peptidase, putative 0.0231 0.3208 0.3154
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0261 0.3714 0.3664
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0432 0.6594 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0432 0.6594 1
Entamoeba histolytica cysteine protease, putative 0.0231 0.3208 0.4803
Brugia malayi Cathepsin L-like precursor 0.0295 0.4285 0.424
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0432 0.6594 1
Plasmodium vivax vivapain-3 0.0231 0.3208 0.4054
Schistosoma mansoni subfamily C1A non-peptidase homologue (C01 family) 0.0093 0.0899 0.0827
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0432 0.6594 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 0.3548 um PUBCHEM_BIOASSAY: qHTS Assay for Identifying the Cell-Membrane Permeable IMPase Inhibitors: Potentiation with Lithium. (Class of assay: confirmatory) [Related pubchem assays: 901 ] ChEMBL. No reference
Potency (functional) 5.6234 uM PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 8.9125 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference
Potency (functional) 10 uM PubChem BioAssay. qHTS for Activators of Integrin-Mediated Alleviation for Muscular Dystrophy. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 56.2341 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference

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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