Detailed information for compound 369671

Basic information

Technical information
  • TDR Targets ID: 369671
  • Name: 4-(4-fluorophenyl)-5-[3-(2-methylpropyl)-[1,2 ,4]triazolo[4,3-a]pyridin-6-yl]-1,3-oxazole
  • MW: 336.363 | Formula: C19H17FN4O
  • H donors: 0 H acceptors: 3 LogP: 4.64 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(Cc1nnc2n1cc(cc2)c1ocnc1c1ccc(cc1)F)C
  • InChi: 1S/C19H17FN4O/c1-12(2)9-17-23-22-16-8-5-14(10-24(16)17)19-18(21-11-25-19)13-3-6-15(20)7-4-13/h3-8,10-12H,9H2,1-2H3
  • InChiKey: RJNVODGSRLWSNQ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 4-(4-fluorophenyl)-5-(3-isobutyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)oxazole
  • 6-[4-(4-fluorophenyl)-1,3-oxazol-5-yl]-3-(2-methylpropyl)-[1,2,4]triazolo[4,5-a]pyridine
  • 6-[4-(4-fluorophenyl)oxazol-5-yl]-3-isobutyl-[1,2,4]triazolo[4,5-a]pyridine
  • 6-[4-(4-fluorophenyl)-5-oxazolyl]-3-isobutyl-[1,2,4]triazolo[4,5-a]pyridine

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens mitogen-activated protein kinase 14 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Brugia malayi P38 map kinase family protein 2 Get druggable targets OG5_128610 All targets in OG5_128610
Trypanosoma brucei mitogen-activated protein kinase 3, putative Get druggable targets OG5_128610 All targets in OG5_128610
Trypanosoma congolense mitogen-activated protein kinase 3, putative Get druggable targets OG5_128610 All targets in OG5_128610
Candida albicans MAP kinase involved in osmoregulation Get druggable targets OG5_128610 All targets in OG5_128610
Echinococcus multilocularis mitogen activated protein kinase 14 Get druggable targets OG5_128610 All targets in OG5_128610
Echinococcus multilocularis mitogen activated protein kinase 11 Get druggable targets OG5_128610 All targets in OG5_128610
Leishmania major mitogen-activated protein kinase 3, putative,map kinase 3, putative Get druggable targets OG5_128610 All targets in OG5_128610
Loa Loa (eye worm) CMGC/MAPK/P38 protein kinase Get druggable targets OG5_128610 All targets in OG5_128610
Schistosoma japonicum ko:K04441 p38 MAP kinase, putative Get druggable targets OG5_128610 All targets in OG5_128610
Leishmania mexicana mitogen-activated protein kinase 3, putative,map kinase 3, putative Get druggable targets OG5_128610 All targets in OG5_128610
Candida albicans MAP kinase involved in osmoregulation Get druggable targets OG5_128610 All targets in OG5_128610
Leishmania braziliensis mitogen-activated protein kinase 3, putative,map kinase 3, putative Get druggable targets OG5_128610 All targets in OG5_128610
Echinococcus multilocularis mitogen activated protein kinase 14 Get druggable targets OG5_128610 All targets in OG5_128610
Echinococcus granulosus mitogen activated protein kinase 14 Get druggable targets OG5_128610 All targets in OG5_128610
Echinococcus granulosus mitogen activated protein kinase 11 Get druggable targets OG5_128610 All targets in OG5_128610
Trypanosoma brucei gambiense mitogen-activated protein kinase 3, putative Get druggable targets OG5_128610 All targets in OG5_128610
Leishmania infantum mitogen-activated protein kinase 3, putative,map kinase 3, putative Get druggable targets OG5_128610 All targets in OG5_128610
Trypanosoma cruzi mitogen-activated protein kinase 3, putative Get druggable targets OG5_128610 All targets in OG5_128610
Echinococcus multilocularis mitogen activated protein kinase 11 Get druggable targets OG5_128610 All targets in OG5_128610
Trypanosoma cruzi mitogen-activated protein kinase 3, putative Get druggable targets OG5_128610 All targets in OG5_128610
Leishmania donovani mitogen-activated protein kinase 3, putative Get druggable targets OG5_128610 All targets in OG5_128610
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Trypanosoma brucei mitogen-activated protein kinase 5 mitogen-activated protein kinase 14 360 aa 336 aa 33.3 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni serine/threonine protein kinase 0.0033 0.0616 0.0825
Echinococcus granulosus cathepsin l1 0.0019 0.0175 0.0235
Echinococcus granulosus protein kinase c iota type 0.0031 0.0536 0.0718
Schistosoma mansoni nAChR subunit (ShAR1-beta2-like) 0.0018 0.0158 0.0211
Leishmania major cathepsin L-like protease 0.0108 0.2949 0.6424
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0018 0.0158 0.025
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0028 0.0467 0.2063
Onchocerca volvulus 0.0019 0.0175 0.1369
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0108 0.2949 0.6781
Trypanosoma cruzi aminopeptidase, putative 0.0037 0.0741 0.1636
Trichomonas vaginalis 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0044 0.0956 0.4417
Loa Loa (eye worm) peptidase family M1 containing protein 0.0037 0.0741 0.0993
Onchocerca volvulus 0.0018 0.0158 0.1177
Giardia lamblia Synaptic glycoprotein SC2 0.0044 0.0956 0.5
Brugia malayi Cathepsin L-like precursor 0.0028 0.0467 0.0741
Echinococcus multilocularis serine:threonine protein kinase N2 0.0018 0.0149 0.0199
Loa Loa (eye worm) hypothetical protein 0.0081 0.2115 0.2833
Echinococcus granulosus Cys loop ligand gated ion channel subunit 0.0018 0.0158 0.0211
Loa Loa (eye worm) AGC/AKT protein kinase 0.0018 0.0149 0.0199
Mycobacterium tuberculosis Probable aminopeptidase PepC 0.0081 0.2115 0.5
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0037 0.0741 0.0993
Loa Loa (eye worm) hypothetical protein 0.0018 0.0158 0.0211
Loa Loa (eye worm) ligand-Gated ion Channel family member 0.0018 0.0158 0.0211
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0018 0.0158 0.025
Echinococcus multilocularis mitogen activated protein kinase 14 0.0152 0.4331 0.5802
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0028 0.0467 0.2063
Trichomonas vaginalis conserved hypothetical protein 0.0038 0.077 0.3522
Onchocerca volvulus 0.0044 0.0956 1
Trypanosoma cruzi cysteine peptidase, putative 0.0108 0.2949 0.6781
Schistosoma mansoni cytosol alanyl aminopeptidase (M01 family) 0.0037 0.0741 0.0993
Echinococcus multilocularis Cys loop ligand gated ion channel subunit 0.0018 0.0158 0.0211
Trichomonas vaginalis AGC family protein kinase 0.0018 0.0149 0.0529
Plasmodium vivax vivapain-2 0.0028 0.0467 0.043
Echinococcus multilocularis cathepsin L cysteine protease 0.0028 0.0467 0.0626
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0037 0.0741 0.3383
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0018 0.0158 0.025
Entamoeba histolytica cysteine proteinase, putative 0.0028 0.0467 0.2063
Onchocerca volvulus 0.0018 0.0158 0.1177
Echinococcus granulosus 3 oxo 5 alpha steroid 4 dehydrogenase C terminal 0.0044 0.0956 0.128
Schistosoma mansoni atypical protein kinase C 0.0031 0.0536 0.0718
Loa Loa (eye worm) hypothetical protein 0.0018 0.0158 0.0211
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0037 0.0741 0.0993
Brugia malayi P38 map kinase family protein 2 0.0152 0.4331 0.6866
Brugia malayi Cathepsin L-like precursor 0.0028 0.0467 0.0741
Echinococcus multilocularis ribosomal protein S6 kinase alpha 3 0.0018 0.0149 0.0199
Brugia malayi Cation transporter family protein 0.0018 0.0158 0.025
Echinococcus granulosus cathepsin l1 0.0028 0.0467 0.0626
Loa Loa (eye worm) hypothetical protein 0.0044 0.0956 0.128
Schistosoma mansoni cathepsin F (C01 family) 0.0028 0.0467 0.0626
Loa Loa (eye worm) fibroinase 0.0028 0.0467 0.0626
Toxoplasma gondii aminopeptidase N protein 0.0335 1 1
Loa Loa (eye worm) acetylcholine receptor alpha subunit 0.0018 0.0158 0.0211
Echinococcus granulosus glycine receptor subunit alpha 1 0.0018 0.0158 0.0211
Onchocerca volvulus 0.0037 0.0741 0.7626
Plasmodium falciparum M18 aspartyl aminopeptidase 0.0081 0.2115 0.2084
Onchocerca volvulus Cathepsin F homolog 0.0028 0.0467 0.4597
Trypanosoma cruzi cruzipain precursor, putative 0.0108 0.2949 0.6781
Echinococcus granulosus mitogen activated protein kinase 14 0.0152 0.4331 0.5802
Schistosoma mansoni serine/threonine protein kinase 0.0114 0.3141 0.4208
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0028 0.0467 0.2063
Echinococcus multilocularis aminopeptidase N 0.0037 0.0741 0.0993
Echinococcus multilocularis unc 13 (munc13) 0.0015 0.0051 0.0069
Loa Loa (eye worm) hypothetical protein 0.0018 0.0158 0.0211
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0028 0.0467 0.2063
Trypanosoma cruzi metallo-peptidase, Clan MH, Family M20 0.0081 0.2115 0.4837
Schistosoma mansoni leukotriene A4 hydrolase (M01 family) 0.0253 0.7464 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0028 0.0467 0.2063
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0037 0.0741 0.3383
Loa Loa (eye worm) aspartyl aminopeptidase 0.0081 0.2115 0.2833
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0028 0.0467 0.2063
Leishmania major mitogen-activated protein kinase 3, putative,map kinase 3, putative 0.0152 0.4331 1
Trypanosoma brucei rac serine-threonine kinase, putative 0.0018 0.0149 0.0256
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0028 0.0467 0.2063
Loa Loa (eye worm) hypothetical protein 0.0018 0.0158 0.0211
Brugia malayi excitatory GABA receptor EXP-1A 0.0018 0.0158 0.025
Echinococcus multilocularis cathepsin L 0.0015 0.0039 0.0052
Loa Loa (eye worm) hypothetical protein 0.0018 0.0158 0.0211
Loa Loa (eye worm) hypothetical protein 0.0044 0.0956 0.128
Trypanosoma cruzi 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0044 0.0956 0.2137
Trypanosoma brucei 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0044 0.0956 0.2137
Echinococcus multilocularis nicotinic acetylcholine receptor a11 subunit 0.0018 0.0158 0.0211
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0037 0.0741 0.0993
Plasmodium falciparum M1-family alanyl aminopeptidase, putative 0.0037 0.0741 0.0705
Brugia malayi Cathepsin L-like precursor 0.0019 0.0175 0.0278
Loa Loa (eye worm) hypothetical protein 0.0044 0.0956 0.128
Brugia malayi Protein kinase domain containing protein 0.0018 0.0149 0.0236
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0018 0.0158 0.025
Echinococcus granulosus ribosomal protein S6 kinase alpha 3 0.0018 0.0149 0.0199
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0108 0.2949 0.6781
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0108 0.2949 0.6781
Schistosoma mansoni aminopeptidase A (M01 family) 0.0037 0.0741 0.0993
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0028 0.0467 0.2063
Trichomonas vaginalis synaptic glycoprotein sc2, putative 0.0044 0.0956 0.4417
Echinococcus granulosus cathepsin L cysteine proteinase 0.0028 0.0467 0.0626
Echinococcus granulosus cathepsin L cysteine protease 0.0015 0.0039 0.0052
Echinococcus granulosus glycine receptor subunit alpha 1 0.0018 0.0158 0.0211
Leishmania major cathepsin L-like protease 0.0108 0.2949 0.6424
Echinococcus multilocularis nicotinic acetylcholine receptor subunit alpha 8 0.0018 0.0158 0.0211
Leishmania major aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1 0.0037 0.0741 0.0709
Trichomonas vaginalis Clan MH, family M18, aspartyl aminopeptidase-like metallopeptidase 0.0038 0.077 0.3522
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0037 0.0741 0.0993
Brugia malayi Protein kinase domain containing protein 0.0018 0.0149 0.0236
Trypanosoma brucei aspartyl aminopeptidase, putative 0.0081 0.2115 0.4837
Loa Loa (eye worm) hypothetical protein 0.0018 0.0158 0.0211
Entamoeba histolytica steroid 5-alpha reductase, putative 0.0044 0.0956 0.4417
Plasmodium falciparum 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0044 0.0956 0.0921
Trypanosoma cruzi puromycin-sensitive aminopeptidase-like protein, putative 0.0037 0.0741 0.1636
Loa Loa (eye worm) hypothetical protein 0.0018 0.0158 0.0211
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0037 0.0741 0.0993
Schistosoma mansoni nAChR subunit 0.0018 0.0158 0.0211
Trypanosoma cruzi Aminopeptidase M1, putative 0.0037 0.0741 0.1636
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0028 0.0467 0.2063
Plasmodium vivax M1-family alanyl aminopeptidase, putative 0.0037 0.0741 0.0705
Loa Loa (eye worm) hypothetical protein 0.0081 0.2109 0.2825
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1 0.0037 0.0741 0.0709
Trichomonas vaginalis AGC family protein kinase 0.0018 0.0149 0.0529
Echinococcus multilocularis ribosomal protein s6 kinase beta 1 0.0018 0.0149 0.0199
Loa Loa (eye worm) aminopeptidase N 0.0037 0.0741 0.0993
Plasmodium vivax M1-family alanyl aminopeptidase, putative 0.0335 1 1
Trypanosoma cruzi metallo-peptidase, clan MA(E), family M1, putative 0.0037 0.0741 0.1636
Loa Loa (eye worm) excitatory GABA receptor EXP-1A 0.0018 0.0158 0.0211
Entamoeba histolytica trans-2,3-enoyl-CoA reductase, putative 0.0044 0.0956 0.4417
Brugia malayi 3-oxo-5-alpha-steroid 4-dehydrogenase 1 0.0044 0.0956 0.1515
Loa Loa (eye worm) hypothetical protein 0.0019 0.0175 0.0235
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0108 0.2949 0.6781
Echinococcus granulosus nicotinic acetylcholine receptor subunit alpha 8 0.0018 0.0158 0.0211
Leishmania major aspartyl aminopeptidase, putative,metallo-peptidase, Clan MH, Family M20 0.0081 0.2115 0.4265
Brugia malayi Cathepsin L-like precursor 0.0019 0.0175 0.0278
Trichomonas vaginalis 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0044 0.0956 0.4417
Onchocerca volvulus 0.0028 0.0467 0.4597
Toxoplasma gondii aminopeptidase n, putative 0.0335 1 1
Plasmodium vivax vivapain-2 0.0028 0.0467 0.043
Plasmodium vivax polyprenol reductase, putative 0.0044 0.0956 0.0921
Echinococcus granulosus glycine receptor subunit beta 0.0018 0.0158 0.0211
Brugia malayi Cation transporter family protein 0.0018 0.0158 0.025
Schistosoma mansoni protein kinase C 0.0015 0.0051 0.0069
Brugia malayi Papain family cysteine protease containing protein 0.0015 0.0039 0.0061
Loa Loa (eye worm) hypothetical protein 0.0018 0.0149 0.0199
Schistosoma mansoni nAChR subunit 0.0018 0.0158 0.0211
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0018 0.0158 0.025
Trypanosoma cruzi major cysteine proteinase, putative 0.0085 0.2229 0.5103
Brugia malayi acetylcholine receptor protein, alpha-like chain, putative 0.0018 0.0158 0.025
Trichomonas vaginalis AGC family protein kinase 0.0018 0.0149 0.0529
Loa Loa (eye worm) ACC-1 protein 0.0018 0.0158 0.0211
Brugia malayi Peptidase family M1 containing protein 0.0037 0.0741 0.1175
Trypanosoma cruzi cysteine peptidase, putative 0.0108 0.2949 0.6781
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0019 0.0175 0.0656
Loa Loa (eye worm) AGC/RSK/MSK protein kinase 0.0018 0.0149 0.0199
Schistosoma mansoni aminopeptidase PILS (M01 family) 0.0037 0.0741 0.0993
Plasmodium vivax 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0044 0.0956 0.0921
Trypanosoma cruzi aminopeptidase, putative 0.0037 0.0741 0.1636
Brugia malayi acetylcholine receptor, alpha-type subunit unc-38 precursor 0.0018 0.0158 0.025
Plasmodium vivax M18 aspartyl aminopeptidase, putative 0.0081 0.2115 0.2084
Leishmania major puromycin-sensitive aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1 0.0037 0.0741 0.0709
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0018 0.0158 0.0211
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0037 0.0741 0.0993
Loa Loa (eye worm) nicotinic acetylcholine receptor alpha subunit 0.0018 0.0158 0.0211
Trypanosoma cruzi cysteine peptidase, putative 0.0028 0.0467 0.0998
Brugia malayi p70 ribosomal S6 kinase beta 0.0018 0.0149 0.0236
Trypanosoma brucei 3-oxo-5-alpha-steroid 4-dehydrogenase-like, putative 0.0044 0.0956 0.2137
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0108 0.2949 0.6781
Loa Loa (eye worm) AGC/RSK/P70 protein kinase 0.0018 0.0149 0.0199
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0028 0.0467 0.2063
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0108 0.2949 0.6781
Trypanosoma brucei metallo-peptidase, Clan MA(E) Family M1 0.0037 0.0741 0.1636
Brugia malayi Cathepsin L-like precursor 0.0028 0.0467 0.0741
Echinococcus granulosus nAChR subunit 0.0018 0.0158 0.0211
Echinococcus granulosus cathepsin L 0.0015 0.0039 0.0052
Onchocerca volvulus 0.0028 0.0467 0.4597
Plasmodium falciparum cysteine proteinase falcipain 3 0.0028 0.0467 0.043
Brugia malayi Peptidase family M1 containing protein 0.0037 0.0741 0.1175
Schistosoma mansoni unc-13 (munc13) 0.0015 0.0051 0.0069
Echinococcus multilocularis glycine receptor subunit beta 0.0018 0.0158 0.0211
Toxoplasma gondii 3-oxo-5-alpha-steroid 4-dehydrogenase 0.0044 0.0956 0.0819
Leishmania major 3-oxo-5-alpha-steroid 4-dehydrogenase-like protein 0.0044 0.0956 0.1265
Trypanosoma cruzi mitogen-activated protein kinase 3, putative 0.0152 0.4331 1
Echinococcus multilocularis leukotriene A 4 hydrolase 0.0253 0.7464 1
Loa Loa (eye worm) AGC/NDR protein kinase 0.0018 0.0149 0.0199
Schistosoma mansoni cathepsin F (C01 family) 0.0019 0.0175 0.0235
Entamoeba histolytica aminopeptidase, putative 0.0081 0.2115 1
Loa Loa (eye worm) AGC/PKC/ALPHA protein kinase 0.0085 0.2219 0.2972
Onchocerca volvulus 0.0037 0.0741 0.7626
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0037 0.0741 0.0993
Loa Loa (eye worm) AGC/RSK/RSK protein kinase 0.0018 0.0149 0.0199
Brugia malayi Hr1 repeat family protein 0.0018 0.0149 0.0236
Echinococcus multilocularis cysteine protease 0.0028 0.0467 0.0626
Echinococcus granulosus protein kinase c epsilon type 0.0033 0.0616 0.0825
Plasmodium falciparum polyprenol reductase, putative 0.0044 0.0956 0.0921
Echinococcus multilocularis mitogen activated protein kinase 14 0.0152 0.4331 0.5802
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0037 0.0741 0.0993
Echinococcus granulosus nicotinic acetylcholine receptor beta 1 subunit 0.0018 0.0158 0.0211
Loa Loa (eye worm) hypothetical protein 0.0037 0.0741 0.0993
Trichomonas vaginalis AGC family protein kinase 0.0018 0.0149 0.0529
Echinococcus granulosus cathepsin l cysteine peptidase 0.0028 0.0467 0.0626
Mycobacterium ulcerans hypothetical protein 0.0044 0.0956 1
Schistosoma mansoni serine/threonine kinase 0.0018 0.0149 0.0199
Brugia malayi nicotinic acetylcholine receptor alpha subunit, putative 0.0018 0.0158 0.025
Loa Loa (eye worm) hypothetical protein 0.0018 0.0158 0.0211
Onchocerca volvulus Cathepsin L homolog 0.0028 0.0467 0.4597
Trypanosoma cruzi puromycin-sensitive aminopeptidase-like protein, putative 0.0037 0.0741 0.1636
Loa Loa (eye worm) AGC/PKN protein kinase 0.0018 0.0149 0.0199
Trypanosoma cruzi cysteine peptidase, putative 0.0108 0.2949 0.6781
Schistosoma mansoni nAChR subunit 0.0018 0.0158 0.0211
Echinococcus granulosus glycine receptor subunit beta 0.0018 0.0158 0.0211
Trypanosoma cruzi metallo-peptidase, Clan MA(E) Family M1 0.0037 0.0741 0.1636
Echinococcus granulosus Ribosomal protein S6 kinase beta 2 0.0018 0.0149 0.0199
Brugia malayi Cathepsin L-like cysteine proteinase 0.0019 0.0175 0.0278
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0099 0.2657 0.6101
Trichomonas vaginalis conserved hypothetical protein 0.0038 0.077 0.3522
Onchocerca volvulus 0.0028 0.0467 0.4597
Echinococcus multilocularis telomerase reverse transcriptase subunit 0.0081 0.2109 0.2825
Loa Loa (eye worm) cysteine protease 0.0028 0.0467 0.0626
Echinococcus granulosus serine:threonine protein kinase N2 0.0018 0.0149 0.0199
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0018 0.0158 0.0211
Brugia malayi hypothetical protein 0.0037 0.0741 0.1175
Trypanosoma cruzi 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0044 0.0956 0.2137
Brugia malayi acetylcholine receptor alpha subunit precursor, putative 0.0018 0.0158 0.025
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0028 0.0467 0.2063
Echinococcus multilocularis protein kinase c epsilon type 0.0033 0.0616 0.0825
Trypanosoma brucei aspartyl aminopeptidase, putative 0.0081 0.2115 0.4837
Brugia malayi hypothetical protein 0.0216 0.6307 1
Schistosoma mansoni aspartyl aminopeptidase (M18 family) 0.0081 0.2115 0.2833
Loa Loa (eye worm) hypothetical protein 0.0018 0.0158 0.0211
Echinococcus multilocularis cysteine protease 0.0028 0.0467 0.0626
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0015 0.0039 0.0052
Echinococcus multilocularis 3 oxo 5 alpha steroid 4 dehydrogenase, C terminal 0.0044 0.0956 0.128
Brugia malayi Cathepsin L-like precursor 0.0028 0.0467 0.0741
Echinococcus multilocularis Ribosomal protein S6 kinase beta 2 0.0018 0.0149 0.0199
Loa Loa (eye worm) hypothetical protein 0.0018 0.0158 0.0211
Trypanosoma cruzi aspartyl aminopeptidase, putative 0.0081 0.2115 0.4837
Onchocerca volvulus 0.0018 0.0158 0.1177
Toxoplasma gondii 3-oxo-5-alpha-steroid 4-dehydrogenase 0.0044 0.0956 0.0819
Brugia malayi Hypothetical glycine receptor like protein T20B12.9 in chromosome III 0.0018 0.0158 0.025
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0018 0.0158 0.0211
Trichomonas vaginalis AGC family protein kinase 0.0018 0.0149 0.0529
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0028 0.0467 0.2063
Trichomonas vaginalis 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0044 0.0956 0.4417
Schistosoma mansoni Tata binding protein associated factor (M01 family) 0.0037 0.0741 0.0993
Echinococcus multilocularis serine:threonine protein kinase N2 0.0018 0.0149 0.0199
Echinococcus granulosus nicotinic acetylcholine receptor subunit type 0.0018 0.0158 0.0211
Loa Loa (eye worm) LGC-31 protein 0.0018 0.0158 0.0211
Onchocerca volvulus 0.0028 0.0467 0.4597
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0028 0.0467 0.0626
Loa Loa (eye worm) hypothetical protein 0.0081 0.2115 0.2833
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0037 0.0741 0.0993
Echinococcus granulosus ribosomal protein s6 kinase beta 1 0.0018 0.0149 0.0199
Trypanosoma brucei Aminopeptidase M1, putative 0.0037 0.0741 0.1636
Toxoplasma gondii cathepsin CPL 0.0028 0.0467 0.0323
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0028 0.0467 0.2063
Echinococcus multilocularis glycine receptor subunit beta 0.0018 0.0158 0.0211
Echinococcus multilocularis Peptidase M1, membrane alanine aminopeptidase, N terminal 0.0037 0.0741 0.0993
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0108 0.2949 0.6781
Brugia malayi protein kinase C II. 0.0033 0.0616 0.0977
Loa Loa (eye worm) hypothetical protein 0.0019 0.0175 0.0235
Brugia malayi gamma-aminobutyric-acid receptor beta subunit precursor 0.0018 0.0158 0.025
Trichomonas vaginalis serine/threonine-protein kinase sgk, putative 0.0017 0.0119 0.0388
Echinococcus multilocularis nicotinic acetylcholine receptor alpha subunit 0.0018 0.0158 0.0211
Schistosoma mansoni serine/threonine protein kinase 0.0018 0.0149 0.0199
Entamoeba histolytica hypothetical protein 0.0044 0.0956 0.4417
Loa Loa (eye worm) hypothetical protein 0.0094 0.2496 0.3344
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0028 0.0467 0.2063
Trichomonas vaginalis Clan MH, family M18, aspartyl aminopeptidase-like metallopeptidase 0.0038 0.077 0.3522
Onchocerca volvulus 0.0028 0.0467 0.4597
Trichomonas vaginalis AGC family protein kinase 0.0018 0.0149 0.0529
Echinococcus granulosus NDR protein kinase 0.0018 0.0149 0.0199
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0108 0.2949 0.6781
Trichomonas vaginalis Clan MH, family M18, aspartyl aminopeptidase-like metallopeptidase 0.0038 0.077 0.3522
Onchocerca volvulus 0.0018 0.0158 0.1177
Echinococcus multilocularis synaptic glycoprotein sc2 0.0044 0.0956 0.128
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0028 0.0467 0.043
Echinococcus multilocularis serine:threonine protein kinase 38 0.0018 0.0149 0.0199
Schistosoma mansoni nAChR subunit 0.0018 0.0158 0.0211
Echinococcus multilocularis Protein kinase C, brain isozyme 0.0114 0.3141 0.4208
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0028 0.0467 0.2063
Loa Loa (eye worm) ACC-1 protein 0.0018 0.0158 0.0211
Schistosoma mansoni serine/threonine protein kinase 0.0018 0.0149 0.0199
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0028 0.0467 0.043
Trichomonas vaginalis synaptic glycoprotein sc2, putative 0.0044 0.0956 0.4417
Loa Loa (eye worm) hypothetical protein 0.0028 0.0467 0.0626
Echinococcus granulosus RNA directed DNA polymerase 0.0081 0.2109 0.2825
Schistosoma mansoni nAChR subunit (ShAR1-beta-like) 0.0018 0.0158 0.0211
Trypanosoma cruzi metallo-peptidase, clan MA(E), family M1, putative 0.0037 0.0741 0.1636
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0018 0.0158 0.025
Entamoeba histolytica aminopeptidase, putative 0.0037 0.0741 0.3383
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0019 0.0175 0.0656
Brugia malayi cathepsin L-like precursor 0.0019 0.0175 0.0278
Entamoeba histolytica cysteine protease, putative 0.0028 0.0467 0.2063
Echinococcus granulosus glycine receptor subunit alpha 1 0.0018 0.0158 0.0211
Leishmania major cathepsin L-like protease 0.0108 0.2949 0.6424
Trichomonas vaginalis AGC family protein kinase 0.0018 0.0149 0.0529
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0028 0.0467 0.2063
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0028 0.0467 0.2063
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0018 0.0158 0.025
Echinococcus granulosus nicotinic acetylcholine receptor alpha subunit 0.0018 0.0158 0.0211
Schistosoma mansoni nAChR subunit 0.0018 0.0158 0.0211
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0028 0.0467 0.0626
Echinococcus multilocularis mitogen activated protein kinase 11 0.0152 0.4331 0.5802
Echinococcus granulosus leukotriene A 4 hydrolase 0.0253 0.7464 1
Echinococcus granulosus mitogen activated protein kinase 11 0.0152 0.4331 0.5802
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0028 0.0467 0.2063
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0108 0.2949 0.6781
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1 0.0037 0.0741 0.0709
Echinococcus multilocularis cathepsin L cysteine protease 0.0028 0.0467 0.0626
Trypanosoma brucei Aminopeptidase M1, putative 0.0037 0.0741 0.1636
Loa Loa (eye worm) TATA binding protein associated factor 0.0037 0.0741 0.0993
Echinococcus granulosus aspartyl aminopeptidase 0.0081 0.2115 0.2833
Loa Loa (eye worm) hypothetical protein 0.0019 0.0175 0.0235
Loa Loa (eye worm) glutamate-gated chloride channel alpha3A subunit 0.0018 0.0158 0.0211
Trypanosoma brucei mitogen-activated protein kinase 3, putative 0.0152 0.4331 1
Echinococcus multilocularis acetylcholine receptor subunit beta 1 0.0018 0.0158 0.0211
Brugia malayi Peptidase family M1 containing protein 0.0037 0.0741 0.1175
Loa Loa (eye worm) hypothetical protein 0.0018 0.0158 0.0211
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0108 0.2949 0.6781
Onchocerca volvulus 0.0037 0.0741 0.7626
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0018 0.0158 0.0211
Brugia malayi Cathepsin L-like precursor 0.0028 0.0467 0.0741
Echinococcus multilocularis aspartyl aminopeptidase 0.0081 0.2115 0.2833
Echinococcus granulosus synaptic glycoprotein sc2 0.0044 0.0956 0.128
Trichomonas vaginalis AGC family protein kinase 0.0018 0.0149 0.0529
Entamoeba histolytica aspartyl aminopeptidase, putative 0.0081 0.2115 1
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0015 0.0039 0.0052
Brugia malayi Papain family cysteine protease containing protein 0.0028 0.0467 0.0741
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0028 0.0467 0.2063
Schistosoma mansoni nAChR subunit 0.0018 0.0158 0.0211
Brugia malayi Synaptic glycoprotein SC2 0.0044 0.0956 0.1515
Brugia malayi Aspartyl aminopeptidase 0.0081 0.2115 0.3353
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0028 0.0467 0.2063
Mycobacterium leprae PROBABLE AMINOPEPTIDASE PEPC 0.0081 0.2115 0.5
Echinococcus multilocularis serine threonine protein kinase 0.0102 0.2754 0.369
Echinococcus granulosus acetylcholine receptor subunit beta 1 0.0018 0.0158 0.0211
Trichomonas vaginalis AGC family protein kinase 0.0018 0.0149 0.0529
Trypanosoma cruzi mitogen-activated protein kinase 3, putative 0.0152 0.4331 1
Echinococcus granulosus protein kinase C gamma type 0.0102 0.2754 0.369
Schistosoma mansoni serine/threonine protein kinase 0.0018 0.0149 0.0199
Entamoeba histolytica cysteine proteinase, putative 0.0019 0.0175 0.0656
Echinococcus multilocularis nicotinic acetylcholine receptor beta 1 subunit 0.0018 0.0158 0.0211
Loa Loa (eye worm) ctsf protein 0.0028 0.0467 0.0626
Onchocerca volvulus 0.0018 0.0158 0.1177
Trypanosoma cruzi 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0044 0.0956 0.2137
Trichomonas vaginalis AGC family protein kinase 0.0018 0.0149 0.0529
Loa Loa (eye worm) leukotriene A4 hydrolase 0.0253 0.7464 1
Brugia malayi TATA binding protein associated factor 0.0037 0.0741 0.1175
Brugia malayi hypothetical protein 0.0037 0.0741 0.1175
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0018 0.0158 0.025
Echinococcus granulosus aminopeptidase N 0.0037 0.0741 0.0993
Loa Loa (eye worm) hypothetical protein 0.0018 0.0158 0.0211
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0028 0.0467 0.2063
Loa Loa (eye worm) AGC/PKC/ETA protein kinase 0.0033 0.0616 0.0825
Onchocerca volvulus 0.0018 0.0158 0.1177
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0015 0.0039 0.0052
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0018 0.0158 0.0211
Loa Loa (eye worm) hypothetical protein 0.0037 0.0741 0.0993
Brugia malayi nicotinic acetylcholine receptor beta-1 chain precursor 0.0018 0.0158 0.025
Trichomonas vaginalis 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0044 0.0956 0.4417
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0028 0.0467 0.2063
Trichomonas vaginalis hypothetical protein 0.0038 0.077 0.3522
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0028 0.0467 0.0626
Schistosoma mansoni synaptic glycoprotein sc2 related 0.0044 0.0956 0.128
Entamoeba histolytica protein kinase, putative 0.0018 0.0149 0.0529
Echinococcus granulosus unc 13 munc13 0.0015 0.0051 0.0069
Loa Loa (eye worm) hypothetical protein 0.0018 0.0158 0.0211
Toxoplasma gondii 3-oxo-5-alpha-steroid 4-dehydrogenase 0.0044 0.0956 0.0819
Echinococcus granulosus neuronal acetylcholine receptor subunit alpha 4 0.0018 0.0158 0.0211
Trichomonas vaginalis conserved hypothetical protein 0.0044 0.0956 0.4417
Entamoeba histolytica cysteine proteinase, putative 0.0028 0.0467 0.2063
Echinococcus multilocularis C2 calcium dependent membrane targeting 0.0015 0.0051 0.0069
Brugia malayi Papain family cysteine protease containing protein 0.0015 0.0039 0.0061
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0037 0.0741 0.3383
Loa Loa (eye worm) hypothetical protein 0.0018 0.0158 0.0211
Entamoeba histolytica 3-oxo-5-alpha-steroid 4-dehydrogenase domain-containing protein 0.0044 0.0956 0.4417
Trichomonas vaginalis Clan MH, family M18, aspartyl aminopeptidase-like metallopeptidase 0.0081 0.2115 1
Trichomonas vaginalis Clan MH, family M18, aspartyl aminopeptidase-like metallopeptidase 0.0081 0.2115 1
Schistosoma mansoni unc-13 (munc13) 0.0015 0.0051 0.0069
Loa Loa (eye worm) hypothetical protein 0.0037 0.0741 0.0993
Echinococcus granulosus cysteine protease 0.0015 0.0039 0.0052
Echinococcus granulosus C2 calcium dependent membrane targeting 0.0015 0.0051 0.0069
Entamoeba histolytica protein kinase, putative 0.0018 0.0149 0.0529
Entamoeba histolytica protein kinase, putative 0.0018 0.0149 0.0529
Loa Loa (eye worm) hypothetical protein 0.0018 0.0158 0.0211
Trichomonas vaginalis conserved hypothetical protein 0.0044 0.0956 0.4417
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0028 0.0467 0.0626
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0028 0.0467 0.2063
Toxoplasma gondii aminopeptidase N, putative 0.0335 1 1
Trichomonas vaginalis Clan MH, family M18, aspartyl aminopeptidase-like metallopeptidase 0.0081 0.2115 1
Loa Loa (eye worm) hypothetical protein 0.0018 0.0158 0.0211
Brugia malayi Protein kinase c protein 2 0.0097 0.2606 0.4131
Schistosoma mansoni aspartyl aminopeptidase (M18 family) 0.0081 0.2115 0.2833
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0018 0.0158 0.0211
Echinococcus multilocularis protein kinase c iota type 0.0031 0.0536 0.0718
Onchocerca volvulus Cathepsin L homolog 0.0028 0.0467 0.4597
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0037 0.0741 0.0993
Onchocerca volvulus Putative nachr subunit 0.0018 0.0158 0.1177
Schistosoma mansoni serine/threonine protein kinase 0.0018 0.0149 0.0199
Trichomonas vaginalis synaptic glycoprotein sc2, putative 0.0044 0.0956 0.4417
Brugia malayi Cathepsin L-like precursor 0.0028 0.0467 0.0741
Echinococcus multilocularis mitogen activated protein kinase 11 0.0152 0.4331 0.5802
Entamoeba histolytica protein kinase, putative 0.0018 0.0149 0.0529
Trichomonas vaginalis AGC family protein kinase 0.0018 0.0149 0.0529
Onchocerca volvulus 0.0028 0.0467 0.4597
Echinococcus granulosus Protein kinase C brain isozyme 0.0114 0.3141 0.4208
Loa Loa (eye worm) hypothetical protein 0.0018 0.0158 0.0211
Echinococcus granulosus nicotinic acetylcholine receptor a11 subunit 0.0018 0.0158 0.0211
Loa Loa (eye worm) nicotinic acetylcholine receptor non-alpha subunit 0.0018 0.0158 0.0211
Onchocerca volvulus 0.0028 0.0467 0.4597
Brugia malayi Protein kinase domain containing protein 0.0018 0.0149 0.0236
Schistosoma mansoni cathepsin F (C01 family) 0.0028 0.0467 0.0626
Loa Loa (eye worm) hypothetical protein 0.0018 0.0158 0.0211
Loa Loa (eye worm) hypothetical protein 0.0018 0.0158 0.0211
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0037 0.0741 0.0993
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0028 0.0467 0.2063
Echinococcus multilocularis nAChR subunit 0.0018 0.0158 0.0211
Schistosoma mansoni nAChR subunit (ShAR1-alpha-like) 0.0018 0.0158 0.0211
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0028 0.0467 0.2063
Loa Loa (eye worm) CMGC/MAPK/P38 protein kinase 0.0152 0.4331 0.5802
Loa Loa (eye worm) hypothetical protein 0.0015 0.0051 0.0069
Trypanosoma brucei aminopeptidase, putative 0.0037 0.0741 0.1636
Schistosoma mansoni serine/threonine protein kinase 0.0114 0.3141 0.4208
Trichomonas vaginalis conserved hypothetical protein 0.0038 0.077 0.3522
Loa Loa (eye worm) AGC/DMPK/GEK protein kinase 0.0018 0.0149 0.0199
Schistosoma mansoni synaptic glycoprotein sc2 related 0.0044 0.0956 0.128
Schistosoma mansoni nAChR subunit 0.0018 0.0158 0.0211
Echinococcus multilocularis neuronal acetylcholine receptor subunit alpha 4 0.0018 0.0158 0.0211
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0018 0.0158 0.025
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0108 0.2949 0.6781
Echinococcus multilocularis RNA directed DNA polymerase 0.0081 0.2109 0.2825
Brugia malayi Cation transporter family protein 0.0018 0.0158 0.025

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) Inhibition of LPS-induced TNFalpha production in human whole blood ChEMBL. 16759861
IC50 (functional) 0 Inhibition of LPS-induced TNFalpha production in human whole blood ChEMBL. 16759861
IC50 (binding) = 8.8 nM Inhibition of p38alpha ChEMBL. 16759861
IC50 (binding) = 8.8 nM Inhibition of p38alpha ChEMBL. 16759861
IC50 (functional) = 70 nM Inhibition of LPS-induced TNFalpha production in human monocytes ChEMBL. 16759861

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.
 
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External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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