Detailed information for compound 1726621

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 379.406 | Formula: C22H21NO5
  • H donors: 0 H acceptors: 2 LogP: 3.15 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=CC=C(c1ccc(c(c1OC)OC)OC)c1ccc2c(c1)c(C=O)cn2C
  • InChi: 1S/C22H21NO5/c1-23-12-15(13-25)18-11-14(5-7-19(18)23)16(9-10-24)17-6-8-20(26-2)22(28-4)21(17)27-3/h5-13H,1-4H3
  • InChiKey: VPTYROHQVMQRKO-UHFFFAOYSA-N  


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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 0.0257 0.5534 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0038 0.0502 0.0502
Echinococcus multilocularis kelch ECH associated protein 1 0.0309 0.6727 0.6713
Trichomonas vaginalis conserved hypothetical protein 0.0082 0.152 0.2583
Loa Loa (eye worm) hypothetical protein 0.0038 0.0502 0.0681
Giardia lamblia Aldose reductase 0.01 0.1918 1
Loa Loa (eye worm) hypothetical protein 0.0018 0.0053 0.0016
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 0.0082 0.152 0.1484
Trichomonas vaginalis aldo-keto reductase, putative 0.0029 0.0292 0.0312
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.0257 0.5534 0.8135
Brugia malayi latrophilin 2 splice variant baaae 0.004 0.0546 0.0539
Brugia malayi beta-lactamase family protein 0.0038 0.0502 0.0495
Onchocerca volvulus 0.0038 0.0502 0.0656
Leishmania major prostaglandin f synthase, putative 0.01 0.1918 1
Brugia malayi hypothetical protein 0.0026 0.0215 0.0208
Echinococcus granulosus survival motor neuron protein 1 0.023 0.4909 0.4888
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0038 0.0502 0.1295
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0038 0.0502 0.0428
Echinococcus granulosus aldo keto reductase 0.01 0.1918 0.1883
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0054 0.0859 0.082
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0054 0.0859 0.0859
Entamoeba histolytica hypothetical protein 0.0024 0.0173 0.0051
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0038 0.0501 0.046
Plasmodium vivax ataxin-2 like protein, putative 0.0026 0.0215 0.1723
Trypanosoma brucei PAB1-binding protein , putative 0.0026 0.0215 0.1123
Mycobacterium tuberculosis Probable oxidoreductase 0.01 0.1918 0.3306
Schistosoma mansoni bromodomain containing protein 0.007 0.1245 0.1245
Onchocerca volvulus 0.01 0.1918 0.5063
Echinococcus granulosus fetal alzheimer antigen falz 0.0024 0.0176 0.0134
Mycobacterium tuberculosis Conserved protein 0.0038 0.0502 0.0428
Leishmania major GTP-binding protein, putative 0.0022 0.0123 0.064
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0054 0.0859 0.0853
Plasmodium vivax aldehyde reductase, putative 0.0029 0.0292 0.3142
Leishmania major aldo-keto reductase-like protein 0.01 0.1918 1
Onchocerca volvulus 0.0047 0.0706 0.1289
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.01 0.1918 0.1883
Trichomonas vaginalis aldo-keto reductase, putative 0.01 0.1918 0.3317
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.01 0.1918 0.1883
Echinococcus granulosus aldo keto reductase 0.01 0.1918 0.1883
Entamoeba histolytica acetyltransferase, GNAT family 0.0039 0.0522 0.0404
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0022 0.0123 0.064
Echinococcus granulosus aldo keto reductase family 1 member B4 0.01 0.1918 0.1883
Loa Loa (eye worm) beta-lactamase 0.0038 0.0502 0.0681
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0024 0.0176 0.0134
Loa Loa (eye worm) acetyltransferase 0.0147 0.3 0.4382
Schistosoma mansoni hypothetical protein 0.0018 0.0053 0.0053
Echinococcus multilocularis aldo keto reductase 0.01 0.1918 0.1883
Toxoplasma gondii aldose reductase, putative 0.01 0.1918 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0038 0.0502 0.0702
Loa Loa (eye worm) oxidoreductase 0.01 0.1918 0.2778
Trypanosoma brucei prostaglandin f synthase 0.01 0.1918 1
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.0215 0.1123
Onchocerca volvulus 0.0038 0.0502 0.0656
Loa Loa (eye worm) hypothetical protein 0.0038 0.0502 0.0681
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0082 0.152 0.2583
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.01 0.1918 0.1883
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0058 0.097 0.1374
Echinococcus granulosus aldo keto reductase family 1 member B4 0.01 0.1918 0.1883
Echinococcus granulosus aldo keto reductase family 1 member B4 0.01 0.1918 0.1883
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0038 0.0502 0.0502
Echinococcus granulosus beta LACTamase domain containing family member 0.0038 0.0502 0.0462
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0038 0.0502 0.0428
Schistosoma mansoni hypothetical protein 0.0018 0.0053 0.0053
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.01 0.1918 0.3317
Leishmania major importin beta-1 subunit, putative 0.0024 0.0173 0.0902
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0045 0.0661 1
Toxoplasma gondii LsmAD domain-containing protein 0.0026 0.0215 0.0517
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0067 0.1159 0.1121
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0082 0.152 0.7929
Loa Loa (eye worm) oxidoreductase 0.01 0.1918 0.2778
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0243 0.521 1
Brugia malayi Latrophilin receptor protein 2 0.0018 0.0053 0.0046
Toxoplasma gondii ABC1 family protein 0.0038 0.0502 0.2115
Loa Loa (eye worm) hypothetical protein 0.0029 0.03 0.0381
Brugia malayi Calcitonin receptor-like protein seb-1 0.0058 0.097 0.0963
Echinococcus multilocularis snurportin 1 0.0312 0.6793 0.6779
Trypanosoma cruzi aldo/keto reductase, putative 0.0029 0.0292 0.1522
Echinococcus granulosus aldo keto reductase family 1 member B4 0.01 0.1918 0.1883
Loa Loa (eye worm) hypothetical protein 0.023 0.4909 0.721
Echinococcus granulosus aldo keto reductase family 1 member B4 0.01 0.1918 0.1883
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.0215 0.2321
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.0502 0.0702
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0054 0.0859 0.082
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative 0.0082 0.152 0.7929
Trichomonas vaginalis aldo-keto reductase, putative 0.01 0.1918 0.3317
Mycobacterium ulcerans lipase LipD 0.0038 0.0502 0.1295
Mycobacterium ulcerans beta-lactamase 0.0038 0.0502 0.1295
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0038 0.0502 0.0495
Schistosoma mansoni pol-related 0.01 0.1918 0.1918
Echinococcus granulosus aldehyde reductase 0.0071 0.1255 0.1217
Brugia malayi beta-lactamase 0.0038 0.0502 0.0495
Mycobacterium tuberculosis Probable lipase LipD 0.0038 0.0502 0.0428
Trichomonas vaginalis aldo/keto reductase, putative 0.01 0.1918 0.3317
Loa Loa (eye worm) hypothetical protein 0.0082 0.152 0.2189
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.01 0.1918 0.1912
Schistosoma mansoni importin beta-1 0.0029 0.03 0.03
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.0502 0.0702
Echinococcus multilocularis aldo keto reductase 0.01 0.1918 0.1883
Schistosoma mansoni survival motor neuron protein 0.0047 0.0706 0.0706
Plasmodium vivax hypothetical protein, conserved 0.0038 0.0502 0.7056
Echinococcus multilocularis geminin 0.0198 0.4182 0.4157
Schistosoma mansoni ran 0.0022 0.0123 0.0123
Onchocerca volvulus 0.01 0.1918 0.5063
Trichomonas vaginalis aldo-keto reductase, putative 0.01 0.1918 0.3317
Onchocerca volvulus 0.01 0.1918 0.5063
Trichomonas vaginalis aldo-keto reductase, putative 0.01 0.1918 0.3317
Schistosoma mansoni hypothetical protein 0.0047 0.0706 0.0706
Toxoplasma gondii oxidoreductase, aldo/keto reductase family protein 0.0029 0.0292 0.0942
Echinococcus granulosus aldo keto reductase family 1 member B4 0.01 0.1918 0.1883
Echinococcus granulosus aldo keto reductase family 1 member B4 0.01 0.1918 0.1883
Echinococcus multilocularis voltage gated potassium channel subunit 0.0029 0.0292 0.025
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.01 0.1918 0.1912
Mycobacterium tuberculosis Conserved protein 0.0038 0.0502 0.0428
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 0.0082 0.152 0.1484
Schistosoma mansoni methyl-cpg binding protein mbd 0.0018 0.0043 0.0043
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0018 0.0043 0.0043
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.0706 0.0699
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0054 0.0859 0.082
Plasmodium vivax importin-beta 2, putative 0.0029 0.03 0.3293
Loa Loa (eye worm) PHD-finger family protein 0.0022 0.0129 0.0129
Trichomonas vaginalis importin beta-1, putative 0.0024 0.0173 0.0093
Trichomonas vaginalis aldo-keto reductase, putative 0.01 0.1918 0.3317
Echinococcus granulosus histone acetyltransferase KAT2B 0.0045 0.0661 0.0621
Loa Loa (eye worm) hypothetical protein 0.0041 0.056 0.0766
Mycobacterium leprae Probable lipase LipE 0.0038 0.0502 0.1295
Leishmania major aldo/keto reductase, putative,aldo/keto reductase family-like protein 0.0029 0.0292 0.1522
Schistosoma mansoni zinc finger protein 0.0024 0.0185 0.0185
Mycobacterium leprae conserved hypothetical protein 0.0038 0.0502 0.1295
Onchocerca volvulus 0.01 0.1918 0.5063
Schistosoma mansoni hypothetical protein 0.0018 0.0053 0.0053
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0018 0.0053 0.0011
Echinococcus granulosus voltage gated potassium channel subunit 0.0029 0.0292 0.025
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.01 0.1918 0.3317
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0266 0.5727 0.8421
Trichomonas vaginalis bromodomain-containing protein, putative 0.0045 0.0661 0.0994
Loa Loa (eye worm) hypothetical protein 0.0038 0.0502 0.0681
Trypanosoma cruzi aldo-keto reductase 0.01 0.1918 1
Loa Loa (eye worm) latrophilin receptor protein 2 0.0018 0.0053 0.0016
Schistosoma mansoni ran 0.0022 0.0123 0.0123
Trichomonas vaginalis glucosylceramidase, putative 0.0257 0.5534 1
Trypanosoma cruzi aldo/keto reductase, putative 0.01 0.1918 1
Echinococcus multilocularis survival motor neuron protein 1 0.023 0.4909 0.4888
Loa Loa (eye worm) oxidoreductase 0.01 0.1918 0.2778
Trichomonas vaginalis glucosylceramidase, putative 0.0178 0.3712 0.6633
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0147 0.3 0.3
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0054 0.0859 0.082
Brugia malayi follicle stimulating hormone receptor 0.0266 0.5727 0.5724
Brugia malayi Bromodomain containing protein 0.0083 0.153 0.1523
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0045 0.0661 0.2998
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0022 0.0123 0.064
Giardia lamblia Histone acetyltransferase GCN5 0.0039 0.0522 0.2226
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.0215 0.2321
Onchocerca volvulus 0.01 0.1918 0.5063
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0054 0.0859 0.0859
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0024 0.0176 0.0176
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 0.0082 0.152 0.1484
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.01 0.1918 0.1883
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.3503 0.6247
Mycobacterium leprae PROBABLE OXIDOREDUCTASE 0.01 0.1918 1
Trypanosoma brucei aldo/keto reductase, putative 0.0029 0.0292 0.1522
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0067 0.1159 0.1121
Entamoeba histolytica ubiquitin carboxyl-terminal hydrolase domain containing protein 0.0082 0.152 0.1415
Echinococcus multilocularis kelch ECH associated protein 1 0.0309 0.6727 0.6713
Toxoplasma gondii aldo-keto reductase 0.0029 0.0292 0.0942
Schistosoma mansoni hypothetical protein 0.004 0.0546 0.0546
Loa Loa (eye worm) oxidoreductase 0.01 0.1918 0.2778
Echinococcus multilocularis GPCR, family 2 0.0018 0.0053 0.0011
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0054 0.0859 0.0859
Brugia malayi glutamate-cysteine ligase modifier subunit 0.0029 0.0292 0.0284
Schistosoma mansoni hypothetical protein 0.0198 0.4182 0.4182
Trichomonas vaginalis conserved hypothetical protein 0.0029 0.0292 0.0312
Trichomonas vaginalis aldo-keto reductase, putative 0.01 0.1918 0.3317
Trichomonas vaginalis alcohol dehydrogenase, putative 0.0029 0.0292 0.0312
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0058 0.097 0.0963
Trypanosoma brucei aldo-keto reductase, putative 0.01 0.1918 1
Trypanosoma cruzi importin beta-1 subunit, putative 0.0024 0.0173 0.0902
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0022 0.0123 0.0119
Mycobacterium ulcerans hypothetical protein 0.0038 0.0502 0.1295
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0018 0.0053 0.0011
Loa Loa (eye worm) hypothetical protein 0.01 0.1918 0.2778
Loa Loa (eye worm) hypothetical protein 0.0047 0.0698 0.0972
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.01 0.1918 0.1883
Echinococcus multilocularis zinc finger protein 0.0024 0.0185 0.0143
Entamoeba histolytica alcohol dehydrogenase, putative 0.0029 0.0292 0.0171
Plasmodium falciparum aldo-keto reductase, putative 0.0029 0.0292 0.4232
Trypanosoma brucei importin beta-1 subunit, putative 0.0029 0.03 0.1564
Loa Loa (eye worm) hypothetical protein 0.0038 0.0502 0.0681
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0038 0.0502 0.0681
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0038 0.0501 0.046
Trichomonas vaginalis aldo-keto reductase, putative 0.0029 0.0292 0.0312
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0018 0.0053 0.0011
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0054 0.0859 0.121
Trichomonas vaginalis glucosylceramidase, putative 0.0257 0.5534 1
Brugia malayi NADH-dependent xylose reductase 0.0029 0.0292 0.0284
Echinococcus granulosus kelch ECH associated protein 1 like 0.0309 0.6727 0.6713
Loa Loa (eye worm) glutamate-cysteine ligase modifier subunit 0.0029 0.0292 0.0369
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.01 0.1918 0.1883
Echinococcus granulosus zinc finger protein 0.0024 0.0185 0.0143
Loa Loa (eye worm) bromodomain containing protein 0.0022 0.0139 0.0142
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 0.0082 0.152 0.7787
Echinococcus granulosus importin subunit beta 1 0.0029 0.03 0.0258
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0018 0.0053 0.0046
Mycobacterium tuberculosis Conserved protein 0.0038 0.0502 0.0428
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0312 0.6793 1
Trichomonas vaginalis aldo-keto reductase, putative 0.01 0.1918 0.3317
Toxoplasma gondii HEAT repeat-containing protein 0.0029 0.03 0.0987
Plasmodium falciparum aldehyde reductase, putative 0.0029 0.0292 0.4232
Echinococcus granulosus kelch ECH associated protein 1 like 0.0309 0.6727 0.6713
Schistosoma mansoni hypothetical protein 0.0312 0.6793 0.6793
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0147 0.3 0.297
Echinococcus granulosus snurportin 1 0.0312 0.6793 0.6779
Brugia malayi hypothetical protein 0.023 0.4909 0.4906
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.3503 0.6247
Trichomonas vaginalis glucosylceramidase, putative 0.0178 0.3712 0.6633
Loa Loa (eye worm) hypothetical protein 0.0058 0.097 0.1374
Trypanosoma brucei hypothetical protein, conserved 0.0038 0.0502 0.262
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.01 0.1918 0.1912
Echinococcus multilocularis Kelch repeat type 1 0.031 0.6747 0.6733
Echinococcus granulosus histone acetyltransferase KAT2B 0.014 0.285 0.2819
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.3503 0.6247
Plasmodium falciparum histone acetyltransferase GCN5 0.0039 0.0522 1
Echinococcus multilocularis aldo keto reductase 0.01 0.1918 0.1883
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0018 0.0043 0.0043
Schistosoma mansoni hypothetical protein 0.0198 0.4182 0.4182
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0045 0.0661 0.2998
Leishmania major hypothetical protein, conserved 0.0038 0.0502 0.262
Plasmodium falciparum importin beta, putative 0.0029 0.03 0.4435
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.3503 0.6247
Loa Loa (eye worm) hypothetical protein 0.0026 0.0215 0.0256
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.01 0.1918 0.1883
Brugia malayi Importin beta-1 subunit 0.0029 0.03 0.0293
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.0502 0.262
Giardia lamblia Aldose reductase 0.01 0.1918 1
Entamoeba histolytica aldose reductase, putative 0.01 0.1918 0.1817
Trichomonas vaginalis aldo-keto reductase, putative 0.01 0.1918 0.3317
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.01 0.1918 0.1912
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0082 0.152 0.1514
Trypanosoma brucei importin beta-1 subunit, putative 0.0029 0.03 0.1564
Trichomonas vaginalis esterase, putative 0.0038 0.0502 0.0702
Schistosoma mansoni hypothetical protein 0.031 0.6747 0.6747
Echinococcus granulosus GPCR family 2 0.0018 0.0053 0.0011
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0024 0.0173 0.0093
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0082 0.152 0.2583
Onchocerca volvulus 0.0038 0.0502 0.0656
Brugia malayi acetyltransferase, GNAT family protein 0.0147 0.3 0.2995
Trichomonas vaginalis glucosylceramidase, putative 0.0257 0.5534 1
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.3503 0.6247
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.01 0.1918 0.3317
Echinococcus granulosus GTP binding nuclear protein Ran 0.0022 0.0123 0.008
Entamoeba histolytica aldose reductase, putative 0.01 0.1918 0.1817
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.0215 0.1123
Toxoplasma gondii aldo/keto reductase family oxidoreductase 0.0029 0.0292 0.0942
Loa Loa (eye worm) hypothetical protein 0.0049 0.0745 0.104
Trichomonas vaginalis aldo-keto reductase, putative 0.01 0.1918 0.3317
Brugia malayi beta-lactamase family protein 0.0038 0.0502 0.0495
Trichomonas vaginalis glucosylceramidase, putative 0.0257 0.5534 1
Echinococcus multilocularis aldehyde reductase 0.0071 0.1255 0.1217
Schistosoma mansoni aldo-keto reductase 0.01 0.1918 0.1918
Mycobacterium ulcerans oxidoreductase 0.01 0.1918 1
Loa Loa (eye worm) hypothetical protein 0.0075 0.1345 0.1929
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0022 0.0123 0.008
Entamoeba histolytica aldose reductase, putative 0.01 0.1918 0.1817
Trichomonas vaginalis aldo/keto reductase, putative 0.01 0.1918 0.3317
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0024 0.0173 0.0093
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.3503 0.6247
Schistosoma mansoni potassium channel beta 0.0029 0.0292 0.0292
Schistosoma mansoni methyl-cpg binding protein mbd 0.0018 0.0043 0.0043
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.0502 0.0702
Schistosoma mansoni aldo-keto reductase 0.01 0.1918 0.1918
Trichomonas vaginalis aldo-keto reductase, putative 0.01 0.1918 0.3317
Echinococcus multilocularis importin subunit beta 1 0.0029 0.03 0.0258
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) 0.0082 0.152 0.152
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.01 0.1918 0.1883
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.3503 0.6247
Echinococcus granulosus aldo keto reductase family 1, member B4 0.0029 0.0292 0.025
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0045 0.0661 0.0994
Trichomonas vaginalis aldo-keto reductase, putative 0.01 0.1918 0.3317
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.0502 0.262
Echinococcus multilocularis beta LACTamase domain containing family member 0.0038 0.0502 0.0462
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0038 0.0502 0.0428
Echinococcus granulosus kelch ECH associated protein 1 0.0309 0.6727 0.6713
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.0257 0.5534 0.553
Loa Loa (eye worm) hypothetical protein 0.0038 0.0502 0.0681
Mycobacterium ulcerans esterase/lipase LipP 0.0038 0.0502 0.1295
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0082 0.152 0.7929
Trichomonas vaginalis glucosylceramidase, putative 0.0257 0.5534 1
Leishmania major hypothetical protein, conserved 0.0026 0.0215 0.1123
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0018 0.0053 0.0011
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 0.0082 0.152 0.1484
Loa Loa (eye worm) hypothetical protein 0.004 0.0546 0.0745
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) 0.0082 0.152 0.152
Plasmodium vivax oxidoreductase, aldo/keto reductase domain containing protein 0.0029 0.0292 0.3142
Brugia malayi RNA, U transporter 1 0.0083 0.1537 0.1531
Echinococcus granulosus hypothetical protein 0.01 0.1918 0.1883
Onchocerca volvulus Glucosylceramidase homolog 0.0169 0.3503 1
Leishmania major aldehyde reductase, putative,oxidoreductase, putative 0.01 0.1918 1
Echinococcus multilocularis ubiquitin specific protease 41 0.0082 0.152 0.1484
Echinococcus granulosus aldo keto reductase family 1 member B4 0.01 0.1918 0.1883
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0022 0.0123 0.064
Schistosoma mansoni hypothetical protein 0.0018 0.0053 0.0053
Trichomonas vaginalis aldo-keto reductase, putative 0.0029 0.0292 0.0312
Brugia malayi PHD-finger family protein 0.003 0.0314 0.0307
Brugia malayi Bromodomain containing protein 0.0044 0.0639 0.0632
Mycobacterium tuberculosis Probable hydrolase 0.0038 0.0502 0.0428
Echinococcus granulosus ubiquitin specific protease 41 0.0082 0.152 0.1484
Echinococcus multilocularis aldo keto reductase 0.01 0.1918 0.1883
Entamoeba histolytica alcohol dehydrogenase, putative 0.0029 0.0292 0.0171
Onchocerca volvulus 0.01 0.1918 0.5063
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0022 0.0123 0.0115
Echinococcus granulosus aldo keto reductase family 1 member B4 0.01 0.1918 0.1883
Loa Loa (eye worm) oxidoreductase 0.01 0.1918 0.2778
Mycobacterium tuberculosis Probable esterase LipL 0.0038 0.0502 0.0428
Leishmania major prostaglandin f2-alpha synthase/D-arabinose dehydrogenase 0.01 0.1918 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0038 0.0502 0.0702
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.01 0.1918 0.1883
Trichomonas vaginalis aldo-keto reductase, putative 0.01 0.1918 0.3317
Echinococcus granulosus geminin 0.0198 0.4182 0.4157
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.01 0.1918 0.1883
Mycobacterium tuberculosis Probable lipase LipE 0.0038 0.0502 0.0428
Echinococcus granulosus aldo keto reductase 0.01 0.1918 0.1883
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative 0.0082 0.152 0.7929
Mycobacterium leprae Conserved hypothetical protein 0.0071 0.1255 0.5922
Trichomonas vaginalis aldo/keto reductase, putative 0.01 0.1918 0.3317
Schistosoma mansoni hypothetical protein 0.0022 0.0129 0.0129
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.01 0.1918 0.1883
Loa Loa (eye worm) hypothetical protein 0.0038 0.0502 0.0681

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) = 300 nM Cytotoxicity against human HT-29 cells assessed as growth inhibition after 72 hrs by XTT assay ChEMBL. 23470139

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23 23470139

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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