Detailed information for compound 204173

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 466.549 | Formula: C25H26N2O5S
  • H donors: 2 H acceptors: 6 LogP: 3.41 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC(=O)CC/C=C\C[C@@H]1CN(C[C@H]1c1ccccc1O)S(=O)(=O)c1cccc2c1ccnc2
  • InChi: 1S/C25H26N2O5S/c28-23-10-5-4-9-21(23)22-17-27(16-19(22)7-2-1-3-12-25(29)30)33(31,32)24-11-6-8-18-15-26-14-13-20(18)24/h1-2,4-6,8-11,13-15,19,22,28H,3,7,12,16-17H2,(H,29,30)/b2-1-/t19-,22-/m1/s1
  • InChiKey: UBJAMZPBAMJFDV-NMAOECDQSA-N  

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity

Obtained from network model

Ranking Plot


Putative Targets List


Species Potential target Raw Global Species
Trichomonas vaginalis glucosylceramidase, putative 0.021 0.2696 0.366
Loa Loa (eye worm) hypothetical protein 0.0092 0.1048 0.1011
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0034 0.0252 0.1045
Echinococcus multilocularis GPCR, family 2 0.0042 0.0366 0.0326
Echinococcus multilocularis mitogen activated protein kinase 3 0.005 0.0474 0.0435
Mycobacterium tuberculosis Probable hydrolase 0.0073 0.0795 0.1209
Mycobacterium tuberculosis Probable esterase LipL 0.0073 0.0795 0.1209
Echinococcus granulosus PHD finger protein rhinoceros 0.0024 0.0107 0.0066
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0042 0.0366 0.0326
Plasmodium falciparum kinesin-5 0.0056 0.0556 1
Schistosoma mansoni leukotriene A4 hydrolase (M01 family) 0.0737 1 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.0437 0.0397
Brugia malayi Kinesin motor domain containing protein 0.0056 0.0556 0.1242
Echinococcus granulosus acetylcholinesterase 0.0131 0.1593 0.1558
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0073 0.0795 0.1718
Brugia malayi hypothetical protein 0.0022 0.0084 0.0188
Trichomonas vaginalis conserved hypothetical protein 0.0032 0.0219 0.0245
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0039 0.0321 0.0385
Mycobacterium ulcerans carboxylesterase, LipT 0.0022 0.0084 0.0098
Trypanosoma cruzi aminopeptidase, putative 0.0039 0.0321 0.3703
Trypanosoma cruzi puromycin-sensitive aminopeptidase-like protein, putative 0.0039 0.0321 0.3703
Mycobacterium tuberculosis Probable lipase LipD 0.0073 0.0795 0.1209
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0265 0.3449 1
Trichomonas vaginalis conserved hypothetical protein 0.0032 0.0219 0.0245
Loa Loa (eye worm) hypothetical protein 0.0032 0.0219 0.0178
Loa Loa (eye worm) kinesin-like protein KLP2 0.0056 0.0556 0.0517
Onchocerca volvulus 0.0039 0.0321 0.147
Loa Loa (eye worm) beta-lactamase 0.0073 0.0795 0.0757
Loa Loa (eye worm) hypothetical protein 0.0131 0.1593 0.1558
Mycobacterium ulcerans protoporphyrinogen oxidase 0.0024 0.0105 0.0145
Loa Loa (eye worm) hypothetical protein 0.0134 0.1636 0.1601
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0073 0.0795 0.0757
Schistosoma mansoni Tata binding protein associated factor (M01 family) 0.0039 0.0321 0.028
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0022 0.0084 0.0069
Echinococcus multilocularis lysine specific demethylase 5A 0.0029 0.0176 0.0135
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0024 0.0107 0.0066
Brugia malayi Peptidase family M1 containing protein 0.0039 0.0321 0.0716
Plasmodium falciparum M1-family alanyl aminopeptidase 0.0039 0.0321 0.478
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0073 0.0795 0.0757
Mycobacterium tuberculosis Conserved protein 0.0073 0.0795 0.1209
Giardia lamblia Kinesin-5 0.0056 0.0556 0.0709
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.0437 0.0397
Trichomonas vaginalis chromobox protein, putative 0.0057 0.0565 0.0722
Trichomonas vaginalis D-aminoacylase, putative 0.0073 0.0795 0.104
Loa Loa (eye worm) carboxylesterase 0.0022 0.0084 0.0043
Brugia malayi hypothetical protein 0.0024 0.0105 0.0235
Echinococcus granulosus lysine specific demethylase 5A 0.0029 0.0176 0.0135
Entamoeba histolytica kinesin, putative 0.0056 0.0556 0.0709
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0039 0.0321 0.028
Echinococcus granulosus chromobox protein 1 0.0057 0.0565 0.0526
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0542 0.7294 1
Brugia malayi hypothetical protein 0.0039 0.0321 0.0716
Plasmodium falciparum M1-family alanyl aminopeptidase, putative 0.0039 0.0321 0.478
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0122 0.1071
Loa Loa (eye worm) hypothetical protein 0.0073 0.0795 0.0757
Loa Loa (eye worm) hypothetical protein 0.0022 0.0084 0.0043
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0131 0.1593 0.1558
Mycobacterium ulcerans monoamine oxidase 0.0024 0.0105 0.0145
Mycobacterium ulcerans oxidoreductase 0.0024 0.0105 0.0145
Brugia malayi Carboxylesterase family protein 0.0022 0.0084 0.0188
Echinococcus granulosus neuroligin 0.0022 0.0084 0.0043
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0122 0.0375
Echinococcus multilocularis neuroligin 0.0022 0.0084 0.0043
Onchocerca volvulus 0.0073 0.0795 0.4423
Echinococcus granulosus carboxylesterase 5A 0.0131 0.1593 0.1558
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.005 0.0474 0.5739
Onchocerca volvulus 0.0039 0.0321 0.147
Schistosoma mansoni gliotactin 0.0022 0.0084 0.0043
Schistosoma mansoni hypothetical protein 0.0042 0.0366 0.0326
Echinococcus multilocularis protoporphyrinogen oxidase 0.0024 0.0105 0.0064
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.005 0.0474 0.5739
Leishmania major hypothetical protein, conserved 0.0025 0.0122 0.1071
Echinococcus multilocularis mitogen activated protein kinase 0.005 0.0474 0.0435
Echinococcus multilocularis carboxylesterase 5A 0.0131 0.1593 0.1558
Echinococcus multilocularis leukotriene A 4 hydrolase 0.0737 1 1
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0073 0.0795 0.1209
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0048 0.0437 0.0976
Brugia malayi Calcitonin receptor-like protein seb-1 0.0134 0.1636 0.3654
Echinococcus granulosus BC026374 protein S09 family 0.0022 0.0084 0.0043
Schistosoma mansoni amine oxidase 0.0024 0.0105 0.0064
Trichomonas vaginalis glucosylceramidase, putative 0.0138 0.1692 0.2276
Trypanosoma cruzi hypothetical protein, conserved 0.0073 0.0795 1
Schistosoma mansoni jumonji/arid domain-containing protein 0.0029 0.0176 0.0135
Mycobacterium tuberculosis Probable flavin-containing monoamine oxidase AofH (amine oxidase) (MAO) 0.0312 0.4103 0.6509
Brugia malayi jmjC domain containing protein 0.0029 0.0176 0.0394
Mycobacterium ulcerans flavin-containing monoamine oxidase AofH 0.0335 0.4431 1
Toxoplasma gondii PHD-finger domain-containing protein 0.0024 0.0107 0.0026
Echinococcus multilocularis 0.0024 0.0105 0.0064
Loa Loa (eye worm) carboxylesterase 0.0022 0.0084 0.0043
Trichomonas vaginalis glucosylceramidase, putative 0.0138 0.1692 0.2276
Loa Loa (eye worm) hypothetical protein 0.0039 0.0321 0.028
Plasmodium vivax hypothetical protein, conserved 0.0024 0.0107 0.0026
Onchocerca volvulus 0.0073 0.0795 0.4423
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0073 0.0795 0.1209
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.005 0.0474 0.5345
Schistosoma mansoni neuroligin 3 (S09 family) 0.0022 0.0084 0.0043
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0542 0.7294 1
Loa Loa (eye worm) hypothetical protein 0.0022 0.0084 0.0043
Trichomonas vaginalis glucosylceramidase, putative 0.021 0.2696 0.366
Trichomonas vaginalis CMGC family protein kinase 0.005 0.0474 0.0597
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0542 0.7294 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0073 0.0795 0.0757
Trichomonas vaginalis penicillin-binding protein, putative 0.0073 0.0795 0.104
Brugia malayi hypothetical protein 0.0039 0.0321 0.0716
Onchocerca volvulus 0.0073 0.0795 0.4423
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0437 0.0397
Trichomonas vaginalis glucosylceramidase, putative 0.0138 0.1692 0.2276
Echinococcus granulosus chromobox protein 1 0.0057 0.0565 0.0526
Trichomonas vaginalis chromobox protein, putative 0.0034 0.0252 0.0291
Leishmania major puromycin-sensitive aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1 0.0039 0.0321 0.3703
Plasmodium falciparum phd finger protein, putative 0.0024 0.0107 0.0039
Trichomonas vaginalis carboxylesterase domain containing protein, putative 0.0022 0.0084 0.0059
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.0041 0.0092
Echinococcus granulosus beta LACTamase domain containing family member 0.0073 0.0795 0.0757
Echinococcus granulosus mitogen activated protein kinase 0.005 0.0474 0.0435
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.0437 0.0397
Mycobacterium tuberculosis Conserved protein 0.0073 0.0795 0.1209
Loa Loa (eye worm) hypothetical protein 0.0024 0.0105 0.0064
Schistosoma mansoni chromobox protein 0.0057 0.0565 0.0526
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0122 0.0375
Trypanosoma cruzi aminopeptidase, putative 0.0039 0.0321 0.3703
Loa Loa (eye worm) hypothetical protein 0.0131 0.1593 0.1558
Echinococcus multilocularis PHD finger protein rhinoceros 0.0024 0.0107 0.0066
Loa Loa (eye worm) hypothetical protein 0.0022 0.0084 0.0043
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0032 0.0219 0.0837
Brugia malayi beta-lactamase family protein 0.0073 0.0795 0.1777
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0022 0.0084 0.0043
Loa Loa (eye worm) jmjC domain-containing protein 0.0049 0.0458 0.0418
Treponema pallidum fructose-bisphosphate aldolase 0.0542 0.7294 0.5
Schistosoma mansoni aminopeptidase A (M01 family) 0.0039 0.0321 0.028
Schistosoma mansoni kinesin eg-5 0.0056 0.0556 0.0517
Schistosoma mansoni hypothetical protein 0.0317 0.418 0.4156
Onchocerca volvulus Alhambra homolog 0.0024 0.0107 0.0141
Mycobacterium tuberculosis Probable lipase LipE 0.0073 0.0795 0.1209
Trypanosoma cruzi metallo-peptidase, clan MA(E), family M1, putative 0.0039 0.0321 0.3703
Loa Loa (eye worm) acetylcholinesterase 1 0.0131 0.1593 0.1558
Trichomonas vaginalis conserved hypothetical protein 0.0023 0.009 0.0067
Loa Loa (eye worm) hypothetical protein 0.0024 0.0107 0.0066
Trypanosoma brucei aminopeptidase, putative 0.0039 0.0321 0.3703
Trypanosoma brucei protein kinase, putative 0.005 0.0474 0.5739
Echinococcus multilocularis acetylcholinesterase 0.0131 0.1593 0.1558
Onchocerca volvulus 0.0025 0.0124 0.0244
Echinococcus multilocularis acetylcholinesterase 0.0131 0.1593 0.1558
Trichomonas vaginalis glucosylceramidase, putative 0.021 0.2696 0.366
Echinococcus granulosus mitogen activated protein kinase 3 0.005 0.0474 0.0435
Loa Loa (eye worm) peptidase family M1 containing protein 0.0039 0.0321 0.028
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.005 0.0474 0.5739
Trichomonas vaginalis glucosylceramidase, putative 0.0145 0.1795 0.2419
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.005 0.0474 0.5739
Echinococcus granulosus acetylcholinesterase 0.0131 0.1593 0.1558
Schistosoma mansoni chromobox protein 0.0057 0.0565 0.0526
Trichomonas vaginalis glucosylceramidase, putative 0.0145 0.1795 0.2419
Trichomonas vaginalis D-aminoacylase, putative 0.0073 0.0795 0.104
Brugia malayi Heterochromatin protein 1 0.0057 0.0565 0.1262
Loa Loa (eye worm) TATA binding protein associated factor 0.0039 0.0321 0.028
Schistosoma mansoni Protoporphyrinogen oxidase chloroplast/mitochondrial precursor 0.0024 0.0105 0.0064
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0039 0.0321 0.0385
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0039 0.0321 0.028
Echinococcus multilocularis chromobox protein 1 0.0057 0.0565 0.0526
Plasmodium vivax M1-family alanyl aminopeptidase, putative 0.0039 0.0321 0.3121
Echinococcus granulosus geminin 0.0317 0.418 0.4156
Plasmodium vivax M1-family alanyl aminopeptidase, putative 0.0039 0.0321 0.3121
Echinococcus granulosus lysine specific histone demethylase 1A 0.0024 0.0105 0.0064
Giardia lamblia Kinase, CMGC MAPK 0.005 0.0474 0.0597
Loa Loa (eye worm) hypothetical protein 0.0024 0.0105 0.0064
Trichomonas vaginalis esterase, putative 0.0073 0.0795 0.104
Brugia malayi Peptidase family M1 containing protein 0.0039 0.0321 0.0716
Trichomonas vaginalis glucosylceramidase, putative 0.021 0.2696 0.366
Loa Loa (eye worm) hypothetical protein 0.0022 0.0084 0.0043
Mycobacterium leprae Probable lipase LipE 0.0073 0.0795 0.2064
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0134 0.1636 0.3654
Brugia malayi Carboxylesterase family protein 0.0022 0.0084 0.0188
Schistosoma mansoni BC026374 protein (S09 family) 0.0022 0.0084 0.0043
Toxoplasma gondii aminopeptidase N protein 0.0039 0.0321 0.3121
Mycobacterium ulcerans beta-lactamase 0.0073 0.0795 0.1718
Echinococcus granulosus peregrin 0.0024 0.0107 0.0066
Loa Loa (eye worm) hypothetical protein 0.0022 0.0084 0.0043
Brugia malayi Bromodomain containing protein 0.0024 0.0107 0.0239
Trichomonas vaginalis CMGC family protein kinase 0.005 0.0474 0.0597
Trichomonas vaginalis chromobox protein, putative 0.0057 0.0565 0.0722
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0542 0.7294 1
Brugia malayi jmjC domain containing protein 0.0078 0.0857 0.1913
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0039 0.0321 0.028
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0039 0.0321 0.028
Schistosoma mansoni hypothetical protein 0.0092 0.1048 0.1011
Giardia lamblia PHD finger protein 15 0.0024 0.0107 0.009
Echinococcus multilocularis lysine specific histone demethylase 1A 0.0024 0.0105 0.0064
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0042 0.0366 0.0326
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0542 0.7294 1
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0073 0.0795 0.1209
Schistosoma mansoni serine/threonine protein kinase 0.005 0.0474 0.0435
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0039 0.0321 0.028
Loa Loa (eye worm) hypothetical protein 0.0025 0.0124 0.0082
Schistosoma mansoni hypothetical protein 0.0376 0.4991 0.497
Loa Loa (eye worm) hypothetical protein 0.0024 0.0105 0.0064
Mycobacterium ulcerans lipase LipD 0.0073 0.0795 0.1718
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.021 0.2696 0.6021
Brugia malayi chromobox protein homolog 3 0.0032 0.0219 0.0489
Echinococcus multilocularis aminopeptidase N 0.0039 0.0321 0.028
Trypanosoma brucei hypothetical protein, conserved 0.0073 0.0795 1
Echinococcus granulosus family S9 non peptidase ue S09 family 0.0022 0.0084 0.0043
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0073 0.0795 0.1777
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.005 0.0474 0.5739
Loa Loa (eye worm) heterochromatin protein 1 0.0057 0.0565 0.0526
Brugia malayi hypothetical protein 0.0025 0.0122 0.0273
Trypanosoma cruzi UDP-galactopyranose mutase 0.0024 0.0105 0.0847
Onchocerca volvulus 0.0039 0.0321 0.147
Trypanosoma cruzi metallo-peptidase, clan MA(E), family M1, putative 0.0039 0.0321 0.3703
Schistosoma mansoni hypothetical protein 0.0317 0.418 0.4156
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1 0.0039 0.0321 0.3703
Mycobacterium tuberculosis Carboxylesterase LipT 0.0022 0.0084 0.0069
Schistosoma mansoni hypothetical protein 0.0042 0.0366 0.0326
Trichomonas vaginalis glucosylceramidase, putative 0.0138 0.1692 0.2276
Mycobacterium tuberculosis Conserved hypothetical protein 0.0024 0.0105 0.0102
Brugia malayi Carboxylesterase family protein 0.0022 0.0084 0.0188
Toxoplasma gondii aminopeptidase N, putative 0.0039 0.0321 0.3121
Entamoeba histolytica aminopeptidase, putative 0.0039 0.0321 0.0385
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0039 0.0321 0.028
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0542 0.7294 1
Schistosoma mansoni amine oxidase 0.0024 0.0105 0.0064
Loa Loa (eye worm) hypothetical protein 0.0024 0.0105 0.0064
Brugia malayi MAP kinase sur-1 0.005 0.0474 0.1059
Onchocerca volvulus 0.0024 0.0105 0.013
Trichomonas vaginalis glucosylceramidase, putative 0.021 0.2696 0.366
Trichomonas vaginalis conserved hypothetical protein 0.0023 0.009 0.0067
Loa Loa (eye worm) leukotriene A4 hydrolase 0.0737 1 1
Schistosoma mansoni cytosol alanyl aminopeptidase (M01 family) 0.0039 0.0321 0.028
Echinococcus granulosus para nitrobenzyl esterase 0.0022 0.0084 0.0043
Brugia malayi beta-lactamase 0.0073 0.0795 0.1777
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0469 0.6281 1
Echinococcus multilocularis para nitrobenzyl esterase 0.0022 0.0084 0.0043
Brugia malayi Latrophilin receptor protein 2 0.0042 0.0366 0.0816
Mycobacterium ulcerans aminopeptidase N PepN 0.0039 0.0321 0.0636
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0078 0.0857 0.0819
Toxoplasma gondii kinesin motor domain-containing protein 0.0056 0.0556 0.6529
Chlamydia trachomatis protoporphyrinogen oxidase 0.0024 0.0105 0.5
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0542 0.7294 1
Trypanosoma cruzi puromycin-sensitive aminopeptidase-like protein, putative 0.0039 0.0321 0.3703
Echinococcus multilocularis geminin 0.0317 0.418 0.4156
Mycobacterium ulcerans hypothetical protein 0.0073 0.0795 0.1718
Loa Loa (eye worm) PHD-finger family protein 0.0024 0.0107 0.0066
Trypanosoma brucei metallo-peptidase, Clan MA(E) Family M1 0.0039 0.0321 0.3703
Trichomonas vaginalis D-aminoacylase, putative 0.0073 0.0795 0.104
Trypanosoma cruzi UDP-galactopyranose mutase 0.0024 0.0105 0.0847
Loa Loa (eye worm) hypothetical protein 0.0041 0.0342 0.0302
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.005 0.0474 0.5739
Trichomonas vaginalis spcc417.12 protein, putative 0.0022 0.0084 0.0059
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0078 0.0857 0.0819
Loa Loa (eye worm) hypothetical protein 0.0024 0.0105 0.0064
Schistosoma mansoni Lysine-specific histone demethylase 1 0.0024 0.0105 0.0064
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0039 0.0321 0.028
Brugia malayi latrophilin 2 splice variant baaae 0.0092 0.1048 0.2341
Echinococcus multilocularis family S9 non peptidase ue (S09 family) 0.0022 0.0084 0.0043
Giardia lamblia Fructose-bisphosphate aldolase 0.0542 0.7294 1
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0022 0.0084 0.0043
Loa Loa (eye worm) hypothetical protein 0.0022 0.0084 0.0043
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0022 0.0084 0.0043
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0039 0.0321 0.028
Leishmania major hypothetical protein, conserved 0.0073 0.0795 1
Trypanosoma brucei PAB1-binding protein , putative 0.0025 0.0122 0.1071
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0542 0.7294 1
Trichomonas vaginalis glucosylceramidase, putative 0.0138 0.1692 0.2276
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.0437 0.0397
Loa Loa (eye worm) hypothetical protein 0.0025 0.0122 0.0081
Trichomonas vaginalis CMGC family protein kinase 0.005 0.0474 0.0597
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.005 0.0474 0.5739
Loa Loa (eye worm) jmjC domain-containing protein 0.0029 0.0176 0.0135
Schistosoma mansoni hypothetical protein 0.0024 0.0107 0.0066
Mycobacterium tuberculosis Possible oxidoreductase 0.0024 0.0105 0.0102
Echinococcus multilocularis jumonji domain containing protein 0.0033 0.0236 0.0195
Schistosoma mansoni hypothetical protein 0.0042 0.0366 0.0326
Trypanosoma cruzi metallo-peptidase, Clan MA(E) Family M1 0.0039 0.0321 0.3703
Brugia malayi Peptidase family M1 containing protein 0.0039 0.0321 0.0716
Loa Loa (eye worm) hypothetical protein 0.0073 0.0795 0.0757
Echinococcus multilocularis BC026374 protein (S09 family) 0.0022 0.0084 0.0043
Loa Loa (eye worm) hypothetical protein 0.0073 0.0795 0.0757
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0022 0.0084 0.0069
Trichomonas vaginalis CMGC family protein kinase 0.005 0.0474 0.0597
Loa Loa (eye worm) hypothetical protein 0.0022 0.0084 0.0043
Echinococcus multilocularis chromobox protein 1 0.0057 0.0565 0.0526
Schistosoma mansoni hypothetical protein 0.0042 0.0366 0.0326
Toxoplasma gondii ABC1 family protein 0.0073 0.0795 1
Echinococcus multilocularis beta LACTamase domain containing family member 0.0073 0.0795 0.0757
Schistosoma mansoni acetylcholinesterase 0.0022 0.0084 0.0043
Trypanosoma cruzi hypothetical protein, conserved 0.0073 0.0795 1
Plasmodium vivax ataxin-2 like protein, putative 0.0025 0.0122 0.0245
Trypanosoma brucei Aminopeptidase M1, putative 0.0039 0.0321 0.3703
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0039 0.0321 0.0385
Loa Loa (eye worm) hypothetical protein 0.0073 0.0795 0.0757
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0542 0.7294 1
Leishmania major UDP-galactopyranose mutase 0.0024 0.0105 0.0847
Brugia malayi beta-lactamase family protein 0.0073 0.0795 0.1777
Plasmodium vivax hypothetical protein, conserved 0.0073 0.0795 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.0105 0.0064
Toxoplasma gondii PHD-finger domain-containing protein 0.0024 0.0107 0.0026
Plasmodium vivax kinesin-5 0.0056 0.0556 0.6529
Loa Loa (eye worm) hypothetical protein 0.0073 0.0795 0.0757
Loa Loa (eye worm) hypothetical protein 0.0039 0.0321 0.028
Trypanosoma brucei Aminopeptidase M1, putative 0.0039 0.0321 0.3703
Trypanosoma cruzi Aminopeptidase M1, putative 0.0039 0.0321 0.3703
Loa Loa (eye worm) aminopeptidase N 0.0039 0.0321 0.028
Trichomonas vaginalis glucosylceramidase, putative 0.021 0.2696 0.366
Loa Loa (eye worm) hypothetical protein 0.0042 0.0366 0.0326
Brugia malayi PHD-finger family protein 0.0024 0.0107 0.0239
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0042 0.0366 0.0326
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.005 0.0474 0.0435
Brugia malayi Carboxylesterase family protein 0.0131 0.1593 0.3558
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0039 0.0321 0.028
Brugia malayi hypothetical protein 0.0339 0.4477 1
Mycobacterium ulcerans dehydrogenase 0.0024 0.0105 0.0145
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0048 0.0437 0.0397
Loa Loa (eye worm) hypothetical protein 0.0073 0.0795 0.0757
Mycobacterium ulcerans aminopeptidase N PepN 0.0039 0.0321 0.0636
Brugia malayi Carboxylesterase family protein 0.0022 0.0084 0.0188
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0265 0.3449 0.7764
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0542 0.7294 1
Toxoplasma gondii LsmAD domain-containing protein 0.0025 0.0122 0.0245
Mycobacterium leprae conserved hypothetical protein 0.0073 0.0795 0.2064
Brugia malayi TATA binding protein associated factor 0.0039 0.0321 0.0716
Echinococcus granulosus GPCR family 2 0.0042 0.0366 0.0326
Brugia malayi amine oxidase, flavin-containing family protein 0.0024 0.0105 0.0235
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0134 0.1636 0.1601
Leishmania major aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1 0.0039 0.0321 0.3703
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0042 0.0366 0.0816
Trichomonas vaginalis glucosylceramidase, putative 0.0138 0.1692 0.2276
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0437 0.0397
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.021 0.2696 0.2666
Echinococcus multilocularis Peptidase M1, membrane alanine aminopeptidase, N terminal 0.0039 0.0321 0.028
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0122 0.1071
Echinococcus granulosus lysine specific histone demethylase 1A 0.0024 0.0105 0.0064
Echinococcus granulosus kinesin family 1 0.0432 0.5769 0.5751
Trichomonas vaginalis chromobox protein, putative 0.0034 0.0252 0.0291
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1 0.0039 0.0321 0.3703
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0042 0.0366 0.0326
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.0041 0.0092
Echinococcus multilocularis kinesin family 1 0.0432 0.5769 0.5751
Loa Loa (eye worm) carboxylesterase 0.0131 0.1593 0.1558
Onchocerca volvulus Glucosylceramidase homolog 0.0138 0.1692 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0073 0.0795 0.104
Brugia malayi SWIRM domain containing protein 0.0024 0.0105 0.0235
Schistosoma mansoni aminopeptidase PILS (M01 family) 0.0039 0.0321 0.028
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0039 0.0321 0.028
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0265 0.3449 0.5462
Mycobacterium ulcerans esterase/lipase LipP 0.0073 0.0795 0.1718
Toxoplasma gondii aminopeptidase n, putative 0.0039 0.0321 0.3121
Loa Loa (eye worm) hypothetical protein 0.0039 0.0321 0.028
Mycobacterium tuberculosis Conserved protein 0.0073 0.0795 0.1209
Loa Loa (eye worm) latrophilin receptor protein 2 0.0042 0.0366 0.0326
Mycobacterium ulcerans flavin-containing monoamine oxidase AofH 0.0335 0.4431 1
Brugia malayi Carboxylesterase family protein 0.0131 0.1593 0.3558
Schistosoma mansoni jumonji/arid domain-containing protein 0.0029 0.0176 0.0135
Schistosoma mansoni jumonji domain containing protein 0.0062 0.0635 0.0596
Echinococcus granulosus jumonji domain containing protein 0.0033 0.0236 0.0195
Echinococcus multilocularis peregrin 0.0024 0.0107 0.0066
Trichomonas vaginalis glucosylceramidase, putative 0.0138 0.1692 0.2276
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0039 0.0321 0.028
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0437 0.0397
Echinococcus granulosus aminopeptidase N 0.0039 0.0321 0.028

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) uM Compound was evaluated for anti-platelet activity by measuring its inhibitory effect on human platelet rich plasma (PRP) aggregated with U-46,619; not tested ChEMBL. No reference
IC50 (functional) 0 uM Compound was evaluated for anti-platelet activity by measuring its inhibitory effect on human platelet rich plasma (PRP) aggregated with U-46,619; not tested ChEMBL. No reference
ID50 (functional) = 56 ug kg-1 Compound was evaluated in vivo for inhibition of U 46619 induced increase in tracheal pressure of guinea pig. ChEMBL. No reference
pA2 (functional) Antagonistic activity against TP-receptor by inhibition of U 46619-induced contraction of isolated guinea pig trachea ChEMBL. No reference
pA2 (functional) 0 Antagonistic activity against TP-receptor by inhibition of U 46619-induced contraction of isolated guinea pig trachea 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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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