Detailed information for compound 1038695

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 225.675 | Formula: C10H12ClN3O
  • H donors: 3 H acceptors: 2 LogP: 1.67 Rotable bonds: 0
    Rule of 5 violations (Lipinski): 1
  • SMILES: Oc1[nH]c2c(n1)c1CNCCc1cc2.Cl
  • InChi: 1S/C10H11N3O.ClH/c14-10-12-8-2-1-6-3-4-11-5-7(6)9(8)13-10;/h1-2,11H,3-5H2,(H2,12,13,14);1H
  • InChiKey: JJEAYRBOEGKDNR-UHFFFAOYSA-N  


Substructure search Similarity search

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
Echinococcus multilocularis dnaJ subfamily B 0.0402 0.4093 0.4093
Echinococcus granulosus cathepsin l1 0.0019 0.0116 0.0155
Plasmodium vivax glutathione reductase, putative 0.0052 0.0459 0.1045
Leishmania major cathepsin L-like protease 0.0074 0.0681 0.1735
Mycobacterium tuberculosis Probable dehydrogenase 0.0119 0.1156 0.2216
Schistosoma mansoni terminal deoxycytidyl transferase 0.0022 0.0139 0.0187
Trypanosoma cruzi major cysteine proteinase, putative 0.0058 0.0517 0.146
Onchocerca volvulus 0.0074 0.0688 0.2583
Leishmania major mitochondrial DNA polymerase beta 0.0339 0.3434 1
Mycobacterium tuberculosis Conserved hypothetical protein 0.0022 0.0139 0.0076
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0018 0.0103 0.0249
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0032 0.0246 0.0329
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0074 0.0688 0.0921
Toxoplasma gondii ABC1 family protein 0.0074 0.0688 0.1614
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0019 0.0116 0.0371
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0048 0.0409 0.1145
Echinococcus multilocularis cathepsin L cysteine protease 0.0019 0.0116 0.0116
Brugia malayi beta-lactamase 0.0074 0.0688 0.2953
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0019 0.0116 0.0371
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0018 0.0103 0.0249
Plasmodium vivax ataxin-2 like protein, putative 0.0054 0.0471 0.1074
Echinococcus granulosus histone acetyltransferase MYST2 0.0055 0.0489 0.0655
Trichomonas vaginalis penicillin-binding protein, putative 0.0074 0.0688 0.2546
Trypanosoma cruzi hypothetical protein, conserved 0.0074 0.0688 0.196
Leishmania major T-complex protein 1, beta subunit, putative 0.0029 0.0216 0.0338
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0034 0.0265 0.0613
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0018 0.0103 0.0249
Mycobacterium ulcerans hypothetical protein 0.0074 0.0688 0.1415
Schistosoma mansoni hypothetical protein 0.0726 0.7464 1
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0022 0.0139 0.0139
Echinococcus multilocularis cysteine protease 0.0019 0.0116 0.0116
Trypanosoma cruzi cysteine peptidase, putative 0.0074 0.0681 0.194
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0019 0.0116 0.0371
Echinococcus multilocularis segment polarity protein dishevelled 0.0009 0.0005 0.0005
Echinococcus granulosus cathepsin l cysteine peptidase 0.0019 0.0116 0.0155
Brugia malayi hypothetical protein 0.0035 0.0282 0.1196
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0019 0.0116 0.0116
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0265 0.0354
Entamoeba histolytica deoxycytidyl transferase, putative 0.0022 0.0139 0.4603
Plasmodium falciparum glutathione reductase 0.0018 0.0103 0.0202
Echinococcus granulosus dnaJ subfamily B 0.0402 0.4093 0.5483
Trichomonas vaginalis DNA polymerase eta, putative 0.0022 0.0139 0.0461
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.0018 0.0103 0.0202
Treponema pallidum 1-deoxy-D-xylulose 5-phosphate reductoisomerase 0.0416 0.4235 1
Plasmodium falciparum cysteine proteinase falcipain 3 0.0019 0.0116 0.0231
Echinococcus granulosus regulator of G protein signaling 7 0.0009 0.0005 0.0007
Mycobacterium tuberculosis Conserved protein 0.0074 0.0688 0.123
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0022 0.0139 0.0109
Echinococcus granulosus segment polarity protein dishevelled 0.0009 0.0005 0.0007
Brugia malayi CXXC zinc finger family protein 0.0028 0.0208 0.0877
Mycobacterium ulcerans lipase LipD 0.0074 0.0688 0.1415
Loa Loa (eye worm) hypothetical protein 0.0177 0.1756 0.7575
Wolbachia endosymbiont of Brugia malayi 1-deoxy-D-xylulose 5-phosphate reductoisomerase 0.0416 0.4235 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0019 0.0116 0.0371
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0019 0.0116 0.0371
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0119 0.1156 0.2216
Trypanosoma brucei hypothetical protein, conserved 0.0074 0.0688 0.196
Loa Loa (eye worm) glutathione reductase 0.0052 0.0459 0.1963
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.2953
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0074 0.0681 0.194
Schistosoma mansoni myelin transcription factor 1 myt1 0.0055 0.0489 0.0655
Mycobacterium tuberculosis Probable lipase LipD 0.0074 0.0688 0.123
Echinococcus multilocularis cathepsin L 0.001 0.0018 0.0018
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0019 0.0116 0.0371
Echinococcus granulosus regulator of G protein signaling 7 0.0009 0.0005 0.0007
Onchocerca volvulus 0.0013 0.0049 0.0166
Loa Loa (eye worm) hypothetical protein 0.0013 0.0049 0.019
Loa Loa (eye worm) T-complex protein 1 0.0029 0.0216 0.091
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.2953
Trypanosoma brucei DNA polymerase kappa, putative 0.0015 0.007 0.0151
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0018 0.0103 0.0138
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0024 0.0164 0.0164
Echinococcus granulosus chaperonin containing TCP1 subunit 2 beta 0.0029 0.0216 0.0289
Brugia malayi Cathepsin L-like precursor 0.0019 0.0116 0.0478
Echinococcus granulosus segment polarity protein dishevelled 0.0009 0.0005 0.0007
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0139 0.0355
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0019 0.0116 0.0478
Loa Loa (eye worm) beta-lactamase 0.0074 0.0688 0.2953
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0074 0.0681 0.194
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0019 0.0116 0.0371
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0018 0.0103 0.0249
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.016 0.158 0.4434
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0019 0.0116 0.0231
Echinococcus granulosus geminin 0.0726 0.7464 1
Trichomonas vaginalis chaperonin-60kD, ch60, putative 0.0029 0.0216 0.0751
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0019 0.0116 0.0371
Loa Loa (eye worm) fibroinase 0.0019 0.0116 0.0478
Echinococcus granulosus beta LACTamase domain containing family member 0.0074 0.0688 0.0921
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0013 0.0049 0.0118
Onchocerca volvulus 0.0019 0.0116 0.0418
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0074 0.0688 0.0921
Onchocerca volvulus 0.0019 0.0116 0.0418
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0013 0.0053 0.0207
Mycobacterium tuberculosis Probable oxidoreductase 0.0133 0.1295 0.2508
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0139 0.0355
Loa Loa (eye worm) hypothetical protein 0.0013 0.0049 0.019
Leishmania major cathepsin L-like protease 0.0019 0.0116 0.0038
Schistosoma mansoni cpg binding protein 0.003 0.0225 0.0301
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0074 0.0681 0.194
Onchocerca volvulus 0.0019 0.0116 0.0418
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0019 0.0116 0.0371
Echinococcus granulosus cpg binding protein 0.003 0.0225 0.0301
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0139 0.0355
Schistosoma mansoni cathepsin F (C01 family) 0.0019 0.0116 0.0155
Toxoplasma gondii NADPH-glutathione reductase 0.0018 0.0103 0.0232
Schistosoma mansoni cpg binding protein 0.0028 0.0208 0.0278
Toxoplasma gondii LsmAD domain-containing protein 0.0054 0.0471 0.1101
Mycobacterium ulcerans hypothetical protein 0.0178 0.1768 0.403
Trypanosoma brucei trypanothione reductase 0.0052 0.0459 0.129
Echinococcus granulosus cathepsin L cysteine proteinase 0.0019 0.0116 0.0155
Brugia malayi Cathepsin L-like precursor 0.0019 0.0116 0.0478
Onchocerca volvulus Cathepsin F homolog 0.0019 0.0116 0.0418
Onchocerca volvulus 0.0019 0.0116 0.0418
Mycobacterium leprae PROBABLE 1-DEOXY-D-XYLULOSE 5-PHOSPHATE REDUCTOISOMERASE DXR (DXP REDUCTOISOMERASE) (1-DEOXYXYLULOSE-5-PHOSPHATE REDUCTOISOMERAS 0.0416 0.4235 1
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0119 0.1156 0.2216
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0019 0.0116 0.0371
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0024 0.0164 0.022
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.2953
Loa Loa (eye worm) CXXC zinc finger family protein 0.0028 0.0208 0.0877
Mycobacterium tuberculosis Probable 1-deoxy-D-xylulose 5-phosphate reductoisomerase Dxr (DXP reductoisomerase) (1-deoxyxylulose-5-phosphate reductoisomeras 0.01 0.0954 0.179
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0018 0.0103 0.0249
Schistosoma mansoni regulator of G protein signaling 0.0009 0.0005 0.0007
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.2953
Echinococcus multilocularis cpg binding protein 0.003 0.0225 0.0225
Echinococcus multilocularis histone acetyltransferase MYST2 0.0055 0.0489 0.0489
Brugia malayi F/Y-rich N-terminus family protein 0.001 0.0017 0.005
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0034 0.0265 0.0265
Trypanosoma cruzi PAB1-binding protein , putative 0.0054 0.0471 0.1325
Echinococcus multilocularis Pleckstrin G protein, interacting region 0.0009 0.0005 0.0005
Echinococcus granulosus cysteine protease 0.001 0.0018 0.0024
Plasmodium vivax hypothetical protein, conserved 0.0074 0.0688 0.1588
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0049 0.0419 0.0562
Schistosoma mansoni hypothetical protein 0.0024 0.0164 0.022
Echinococcus multilocularis geminin 0.0726 0.7464 0.7464
Giardia lamblia TCP-1 chaperonin subunit beta 0.0029 0.0216 1
Brugia malayi Cathepsin L-like precursor 0.0019 0.0116 0.0478
Brugia malayi cathepsin L-like precursor 0.0013 0.0049 0.019
Schistosoma mansoni DNA polymerase eta 0.0022 0.0139 0.0187
Echinococcus multilocularis thioredoxin glutathione reductase 0.0052 0.0459 0.0459
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0013 0.0053 0.0207
Plasmodium falciparum thioredoxin reductase 0.0052 0.0459 0.1045
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0139 0.0355
Echinococcus multilocularis dna polymerase eta 0.0022 0.0139 0.0139
Trichomonas vaginalis esterase, putative 0.0074 0.0688 0.2546
Trypanosoma cruzi DNA polymerase eta, putative 0.0022 0.0139 0.0355
Brugia malayi Pre-SET motif family protein 0.0231 0.2317 1
Plasmodium falciparum ataxin-2 like protein, putative 0.0054 0.0471 0.1074
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0019 0.0116 0.0116
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0067 0.0614 0.1746
Mycobacterium ulcerans DNA polymerase IV 0.0022 0.0139 0.0088
Echinococcus granulosus cathepsin L cysteine protease 0.001 0.0018 0.0024
Entamoeba histolytica hypothetical protein 0.0035 0.0282 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0013 0.0049 0.0118
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0074 0.0681 0.194
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0074 0.0681 0.194
Chlamydia trachomatis 1-deoxy-D-xylulose 5-phosphate reductoisomerase 0.0416 0.4235 1
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0339 0.3434 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0074 0.0681 0.194
Entamoeba histolytica T-complex protein 1 beta subunit, putative 0.0029 0.0216 0.7495
Entamoeba histolytica hypothetical protein 0.0035 0.0282 1
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0074 0.0688 0.123
Schistosoma mansoni dishevelled 0.0009 0.0005 0.0007
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0019 0.0116 0.0371
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0339 0.3434 1
Leishmania major cathepsin L-like protease 0.0074 0.0681 0.1735
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0133 0.1295 0.2508
Brugia malayi hypothetical protein 0.0054 0.0471 0.2015
Echinococcus granulosus cathepsin l1 0.0013 0.0049 0.0066
Trypanosoma brucei unspecified product 0.0015 0.007 0.0151
Trypanosoma brucei unspecified product 0.0015 0.007 0.0151
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0119 0.1156 0.1321
Toxoplasma gondii t-complex protein beta subunit 0.0029 0.0216 0.0497
Trypanosoma brucei DNA polymerase IV, putative 0.0022 0.0139 0.0355
Loa Loa (eye worm) hypothetical protein 0.0019 0.0116 0.0478
Onchocerca volvulus Cathepsin L homolog 0.0019 0.0116 0.0418
Plasmodium vivax SET domain protein, putative 0.0034 0.0265 0.0584
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0019 0.0116 0.0371
Loa Loa (eye worm) hypothetical protein 0.0034 0.0265 0.1122
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0055 0.0489 0.2093
Brugia malayi Pre-SET motif family protein 0.0034 0.0265 0.1122
Echinococcus multilocularis regulator of G protein signaling 7 0.0009 0.0005 0.0005
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0139 0.0355
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0061 0.0549 0.0736
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0265 0.0354
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0018 0.0103 0.0249
Schistosoma mansoni hypothetical protein 0.0035 0.0282 0.0377
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0048 0.0409 0.1145
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0139 0.0355
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.0282 0.0377
Mycobacterium ulcerans esterase/lipase LipP 0.0074 0.0688 0.1415
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0018 0.0103 0.0249
Schistosoma mansoni hypothetical protein 0.0295 0.2982 0.3995
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0034 0.0265 0.0265
Echinococcus granulosus dna polymerase kappa 0.0022 0.0139 0.0187
Schistosoma mansoni chaperonin containing t-complex protein 1 beta subunit tcpb 0.0029 0.0216 0.0289
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0019 0.0116 0.0371
Trypanosoma brucei DNA polymerase IV, putative 0.0022 0.0139 0.0355
Echinococcus multilocularis dna polymerase kappa 0.0022 0.0139 0.0139
Plasmodium falciparum T-complex protein 1 subunit beta 0.0029 0.0216 0.0468
Mycobacterium tuberculosis Conserved protein 0.0074 0.0688 0.123
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0019 0.0116 0.0371
Loa Loa (eye worm) mbt repeat family protein 0.0049 0.0419 0.1791
Leishmania major DNA polymerase eta, putative 0.0022 0.0139 0.0109
Echinococcus multilocularis beta LACTamase domain containing family member 0.0074 0.0688 0.0688
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0119 0.1156 0.2216
Plasmodium falciparum glutathione reductase 0.0052 0.0459 0.1045
Mycobacterium tuberculosis Probable esterase LipL 0.0074 0.0688 0.123
Leishmania major cathepsin L-like protease 0.0019 0.0116 0.0038
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0018 0.0103 0.0249
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0022 0.0139 0.0581
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0022 0.0139 0.0076
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0034 0.0265 0.0354
Onchocerca volvulus 0.0049 0.0419 0.1566
Trypanosoma cruzi cysteine peptidase, putative 0.0019 0.0116 0.0286
Echinococcus granulosus histone lysine methyltransferase setb 0.0034 0.0265 0.0354
Brugia malayi ImpB/MucB/SamB family protein 0.0022 0.0139 0.0581
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0018 0.0103 0.0202
Brugia malayi hypothetical protein 0.0035 0.0274 0.1162
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0074 0.0681 0.194
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.001 0.0018 0.0024
Leishmania major cathepsin L-like protease 0.0074 0.0681 0.1735
Schistosoma mansoni chaperonin containing t-complex protein 1 beta subunit tcpb 0.0029 0.0216 0.0289
Giardia lamblia DINP protein human, muc B family 0.0022 0.0139 0.3224
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0019 0.0116 0.0371
Trypanosoma cruzi DNA polymerase kappa, putative 0.0022 0.0139 0.0355
Echinococcus multilocularis polycomb protein SCMH1 0.0049 0.0419 0.0419
Onchocerca volvulus 0.0034 0.0265 0.0982
Brugia malayi Cathepsin L-like precursor 0.0019 0.0116 0.0478
Trypanosoma cruzi DNA polymerase kappa, putative 0.0022 0.0139 0.0355
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0058 0.0518 0.1462
Plasmodium falciparum ataxin-2 like protein, putative 0.0054 0.0471 0.1074
Plasmodium vivax vivapain-2 0.0019 0.0116 0.0231
Schistosoma mansoni dishevelled 0.0009 0.0005 0.0007
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0133 0.1295 0.1711
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.2953
Trichomonas vaginalis D-aminoacylase, putative 0.0074 0.0688 0.2546
Entamoeba histolytica cysteine proteinase, putative 0.0019 0.0116 0.3702
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0055 0.0489 0.0655
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0022 0.0139 0.0461
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0074 0.0681 0.194
Onchocerca volvulus 0.0263 0.2648 1
Leishmania major hypothetical protein, conserved 0.0054 0.0471 0.1104
Onchocerca volvulus 0.0019 0.0116 0.0418
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.016 0.158 0.4573
Trichomonas vaginalis mercuric reductase, putative 0.0018 0.0103 0.0323
Trypanosoma cruzi cysteine peptidase, putative 0.0074 0.0681 0.194
Mycobacterium ulcerans 1-deoxy-D-xylulose 5-phosphate reductoisomerase 0.0416 0.4235 1
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0055 0.0489 0.0489
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0019 0.0116 0.0371
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.001 0.0018 0.0024
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0018 0.0103 0.0103
Loa Loa (eye worm) hypothetical protein 0.0074 0.0688 0.2953
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0074 0.0681 0.194
Loa Loa (eye worm) MBCTL1 0.0055 0.0489 0.2093
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0019 0.0116 0.0371
Mycobacterium ulcerans DNA polymerase IV 0.0022 0.0139 0.0088
Leishmania major cysteine peptidase A (CPA) 0.0019 0.0116 0.0038
Mycobacterium tuberculosis Probable hydrolase 0.0074 0.0688 0.123
Echinococcus granulosus dna polymerase eta 0.0022 0.0139 0.0187
Onchocerca volvulus 0.0074 0.0688 0.2583
Trypanosoma cruzi trypanothione reductase, putative 0.0052 0.0459 0.129
Entamoeba histolytica hypothetical protein 0.0035 0.0282 1
Entamoeba histolytica cysteine protease, putative 0.0019 0.0116 0.3702
Trichomonas vaginalis D-aminoacylase, putative 0.0074 0.0688 0.2546
Mycobacterium tuberculosis Probable reductase 0.0119 0.1156 0.2216
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0074 0.0681 0.194
Echinococcus multilocularis cysteine protease 0.0019 0.0116 0.0116
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0019 0.0116 0.0371
Trypanosoma brucei unspecified product 0.0022 0.0139 0.0355
Loa Loa (eye worm) hypothetical protein 0.0055 0.0489 0.2093
Trypanosoma cruzi trypanothione reductase, putative 0.0018 0.0103 0.0249
Trypanosoma brucei T-complex protein 1, beta subunit, putative 0.0029 0.0216 0.0578
Loa Loa (eye worm) histone methyltransferase 0.001 0.0018 0.0055
Brugia malayi Cathepsin L-like precursor 0.0019 0.0116 0.0478
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.001 0.0018 0.0024
Trichomonas vaginalis D-aminoacylase, putative 0.0074 0.0688 0.2546
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0074 0.0688 0.2953
Brugia malayi Thioredoxin reductase 0.0052 0.0459 0.1963
Trypanosoma cruzi hypothetical protein, conserved 0.0074 0.0688 0.196
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.001 0.0018 0.0024
Schistosoma mansoni cathepsin F (C01 family) 0.0019 0.0116 0.0155
Brugia malayi Cathepsin L-like cysteine proteinase 0.0013 0.0049 0.019
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0018 0.0103 0.0249
Echinococcus granulosus cathepsin L 0.001 0.0018 0.0024
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0048 0.0409 0.1145
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.0018 0.0103 0.0202
Mycobacterium tuberculosis Conserved hypothetical protein 0.0178 0.1768 0.3504
Schistosoma mansoni dep domain containing protein 0.0009 0.0005 0.0007
Onchocerca volvulus Cathepsin L homolog 0.0019 0.0116 0.0418
Schistosoma mansoni sex comb on midleg homolog 0.0049 0.0419 0.0562
Schistosoma mansoni cathepsin F (C01 family) 0.0013 0.0049 0.0066
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.0282 0.0377
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0048 0.0409 0.1145
Loa Loa (eye worm) hypothetical protein 0.0054 0.0471 0.2015
Schistosoma mansoni fyve finger-containing phosphoinositide kinase fyv1 0.0009 0.0006 0.0007
Brugia malayi Papain family cysteine protease containing protein 0.0019 0.0116 0.0478
Schistosoma mansoni sex comb on midleg homolog 0.0049 0.0419 0.0562
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0019 0.0116 0.0231
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0074 0.0688 0.123
Brugia malayi T-complex protein 1, beta subunit 0.0029 0.0216 0.091
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0019 0.0116 0.0371
Mycobacterium tuberculosis Probable lipase LipE 0.0074 0.0688 0.123
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0475 0.4855 1
Leishmania major DNA polymerase kappa, putative 0.0022 0.0139 0.0109
Echinococcus multilocularis segment polarity protein dishevelled 0.0009 0.0005 0.0005
Trypanosoma cruzi DNA polymerase kappa, putative 0.0022 0.0139 0.0355
Toxoplasma gondii hypothetical protein 0.0055 0.0482 0.1128
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.0282 0.0282
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0019 0.0116 0.0371
Schistosoma mansoni cpg binding protein 0.003 0.0225 0.0301
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.001 0.0018 0.0018
Trypanosoma brucei DNA polymerase IV, putative 0.0022 0.0139 0.0355
Echinococcus multilocularis SAM and MBT domain containing protein 0.0049 0.0419 0.0419
Brugia malayi mbt repeat family protein 0.0049 0.0419 0.1791
Trypanosoma brucei DNA polymerase kappa, putative 0.0015 0.007 0.0151
Brugia malayi N-terminal motif family protein 0.0177 0.1756 0.7575
Toxoplasma gondii thioredoxin reductase 0.0052 0.0459 0.1073
Leishmania major cathepsin L-like protease 0.0019 0.0116 0.0038
Toxoplasma gondii 1-deoxy-D-xylulose 5-phosphate reductoisomerase, putative 0.0416 0.4235 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0139 0.0355
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0019 0.0116 0.0371
Plasmodium vivax T-complex protein 1 subunit beta, putative 0.0029 0.0216 0.0468
Schistosoma mansoni chaperonin containing t-complex protein 1 beta subunit tcpb 0.0029 0.0216 0.0289
Entamoeba histolytica hypothetical protein 0.0035 0.0282 1
Loa Loa (eye worm) thioredoxin reductase 0.0052 0.0459 0.1963
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0231 0.2317 1
Mycobacterium ulcerans beta-lactamase 0.0074 0.0688 0.1415
Leishmania major hypothetical protein, conserved 0.0074 0.0688 0.1755
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0074 0.0688 0.123
Loa Loa (eye worm) ctsf protein 0.0019 0.0116 0.0478
Trichomonas vaginalis set domain proteins, putative 0.0263 0.2648 1
Brugia malayi T-complex protein 1, beta subunit 0.0029 0.0216 0.091
Onchocerca volvulus 0.0074 0.0688 0.2583
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0339 0.3434 1
Toxoplasma gondii cathepsin CPL 0.0019 0.0116 0.0261
Brugia malayi ImpB/MucB/SamB family protein 0.0022 0.0139 0.0581
Brugia malayi Cathepsin L-like precursor 0.0013 0.0049 0.019
Trichomonas vaginalis glutathione reductase, putative 0.0018 0.0103 0.0323
Trypanosoma cruzi cruzipain precursor, putative 0.0074 0.0681 0.194
Leishmania major cathepsin L-like protease 0.0019 0.0116 0.0038
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0133 0.1295 0.2508
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0018 0.0103 0.0202
Leishmania major cathepsin L-like protease 0.0019 0.0116 0.0038
Plasmodium falciparum thioredoxin reductase 0.0018 0.0103 0.0202
Brugia malayi Cathepsin L-like precursor 0.0013 0.0049 0.019
Plasmodium vivax vivapain-2 0.0019 0.0116 0.0231
Echinococcus granulosus polycomb protein SCMH1 0.0049 0.0419 0.0562
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0265 0.0354
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0018 0.0103 0.0249
Loa Loa (eye worm) hypothetical protein 0.0022 0.0139 0.0581
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0018 0.0103 0.0424
Schistosoma mansoni hypothetical protein 0.0726 0.7464 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0139 0.0355
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0139 0.0355
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0018 0.0103 0.0138
Entamoeba histolytica cysteine proteinase, putative 0.0013 0.0049 0.1178
Entamoeba histolytica cysteine proteinase, putative 0.0019 0.0116 0.3702
Plasmodium vivax 1-deoxy-D-xylulose 5-phosphate reductoisomerase, putative 0.0416 0.4235 1
Trypanosoma cruzi PAB1-binding protein , putative 0.0054 0.0471 0.1325
Plasmodium falciparum 1-deoxy-D-xylulose 5-phosphate reductoisomerase 0.0416 0.4235 1
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0018 0.0103 0.0232
Trypanosoma brucei PAB1-binding protein , putative 0.0054 0.0471 0.1325
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0019 0.0116 0.0371
Echinococcus multilocularis regulator of G protein signaling 7 0.0009 0.0005 0.0005
Loa Loa (eye worm) hypothetical protein 0.0049 0.0419 0.1791
Echinococcus multilocularis cathepsin L cysteine protease 0.0019 0.0116 0.0116
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0074 0.0688 0.2953
Toxoplasma gondii histone lysine methyltransferase SET1 0.0055 0.0483 0.1129
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0019 0.0116 0.0371
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0018 0.0103 0.0249
Echinococcus granulosus Pleckstrin G protein interacting region 0.0009 0.0005 0.0007
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.016 0.158 0.4573
Brugia malayi Papain family cysteine protease containing protein 0.001 0.0018 0.0056
Echinococcus granulosus SAM and MBT domain containing protein 0.0049 0.0419 0.0562
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0019 0.0116 0.0371
Trypanosoma cruzi cysteine peptidase, putative 0.0074 0.0681 0.194
Trypanosoma brucei DNA polymerase kappa, putative 0.0015 0.007 0.0151
Brugia malayi beta-lactamase family protein 0.0074 0.0688 0.2953
Brugia malayi Cathepsin L-like precursor 0.0019 0.0116 0.0478
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0022 0.0139 0.0187
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0119 0.1156 0.2216
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0052 0.0459 0.0749
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0177 0.1756 0.6627
Trichomonas vaginalis chaperonin, putative 0.0029 0.0216 0.0751
Loa Loa (eye worm) hypothetical protein 0.0013 0.0049 0.019
Brugia malayi mbt repeat family protein 0.0049 0.0419 0.1791
Leishmania major trypanothione reductase 0.0052 0.0459 0.1068
Schistosoma mansoni z-protein (S1r protein) 0.0009 0.0005 0.0007
Trichomonas vaginalis penicillin-binding protein, putative 0.0074 0.0688 0.2546
Trypanosoma cruzi DNA polymerase kappa, putative 0.0022 0.0139 0.0355
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0139 0.0355
Echinococcus granulosus thioredoxin glutathione reductase 0.0052 0.0459 0.0615
Onchocerca volvulus 0.0028 0.0208 0.0767
Trypanosoma cruzi T-complex protein 1, beta subunit, putative 0.0029 0.0216 0.0578
Mycobacterium tuberculosis Conserved protein 0.0074 0.0688 0.123
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0018 0.0103 0.0249
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0019 0.0116 0.0371
Onchocerca volvulus 0.0019 0.0116 0.0418
Schistosoma mansoni hypothetical protein 0.0402 0.4093 0.5483
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0049 0.0419 0.1566
Echinococcus multilocularis chaperonin containing TCP1, subunit 2 (beta) 0.0029 0.0216 0.0216
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0022 0.0139 0.0187
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0074 0.0681 0.194
Brugia malayi glutathione reductase 0.0052 0.0459 0.1963
Plasmodium vivax thioredoxin reductase, putative 0.0052 0.0459 0.1045
Brugia malayi Papain family cysteine protease containing protein 0.001 0.0018 0.0056
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0074 0.0688 0.1415
Loa Loa (eye worm) cysteine protease 0.0019 0.0116 0.0478
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0191 0.1903 0.255
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0019 0.0116 0.0478
Brugia malayi beta-lactamase family protein 0.0074 0.0688 0.2953
Onchocerca volvulus 0.0019 0.0116 0.0418
Trypanosoma brucei DNA polymerase eta, putative 0.0022 0.0139 0.0355
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0191 0.1903 0.1903

Activities

Activity type Activity value Assay description Source Reference
Inhibition (functional) = 1 % Ability to inhibit rabbit adrenal PNMT norepinephrine to epinephrine (E13), in vitro, at 10 e-6 M ChEMBL. 2738892
Inhibition (functional) = 4 % Ability to inhibit rabbit adrenal PNMT norepinephrine to epinephrine (E13), in vitro, at 10 e-4 M compound concentration. ChEMBL. 2738892

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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