Detailed information for compound 15359

Basic information

Technical information
  • TDR Targets ID: 15359
  • Name: N-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]py rrol-2-yl)-5-(4-chlorophenyl)-1-(2,4-dichloro phenyl)-4-methylpyrazole-3-carboxamide
  • MW: 489.825 | Formula: C24H23Cl3N4O
  • H donors: 1 H acceptors: 2 LogP: 6.96 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccc(cc1)c1c(C)c(nn1c1ccc(cc1Cl)Cl)C(=O)NN1CC2C(C1)CCC2
  • InChi: 1S/C24H23Cl3N4O/c1-14-22(24(32)29-30-12-16-3-2-4-17(16)13-30)28-31(21-10-9-19(26)11-20(21)27)23(14)15-5-7-18(25)8-6-15/h5-11,16-17H,2-4,12-13H2,1H3,(H,29,32)
  • InChiKey: FBKYHSUORADGSF-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-pyrazole-3-carboxamide
  • N-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-3-pyrazolecarboxamide

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens cannabinoid receptor 1 (brain) Starlite/ChEMBL References

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
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0015 0.0029 0.0073
Schistosoma mansoni bifunctional dihydrofolate reductase-thymidylate synthase 0.0156 0.1128 0.1102
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0018 0.0047 0.0235
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0017 0.004 0.0102
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0037 0.0201 0.0419
Schistosoma mansoni phosphoglucomutase 0.0066 0.0422 0.0395
Mycobacterium leprae PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE) 0.0111 0.0776 0.4544
Loa Loa (eye worm) hypothetical protein 0.0018 0.0047 0.0105
Toxoplasma gondii NADPH-glutathione reductase 0.0017 0.004 0.0154
Trypanosoma cruzi transcription factor btf3, putative 0.0034 0.0173 0.0446
Entamoeba histolytica phosphofructokinase, putative 0.0111 0.0776 0.1995
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.003 0.0143 0.1044
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0015 0.0029 0.004
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0048 0.0286 0.2345
Trichomonas vaginalis conserved hypothetical protein 0.0074 0.0489 0.1256
Trichomonas vaginalis DNA helicase recq, putative 0.0022 0.0079 0.0204
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0017 0.004 0.0141
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0037 0.0201 0.0517
Giardia lamblia Thymidine kinase 0.0509 0.3891 1
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.011 0.0769 0.674
Schistosoma mansoni 6-phosphofructokinase 0.0111 0.0776 0.075
Entamoeba histolytica transcription factor BTF3, putative 0.0034 0.0173 0.0446
Trypanosoma brucei thymidine kinase 0.0509 0.3891 1
Brugia malayi hypothetical protein 0.0228 0.1697 0.947
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0018 0.0047 0.0235
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0111 0.0776 1
Plasmodium vivax thioredoxin reductase, putative 0.0048 0.0286 0.2375
Entamoeba histolytica phosphofructokinase, putative 0.0111 0.0776 0.1995
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0018 0.0047 0.0235
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.0274 0.1504
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.0017 0.004 0.0102
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.0173 0.0446
Chlamydia trachomatis thymidylate kinase 0.0073 0.0483 1
Trypanosoma brucei RNA helicase, putative 0.0386 0.2933 0.7539
Treponema pallidum exodeoxyribonuclease (exoA) 0.0037 0.0201 0.2193
Brugia malayi Intermediate filament tail domain containing protein 0.0054 0.0328 0.1808
Echinococcus granulosus thioredoxin glutathione reductase 0.0048 0.0286 0.0651
Loa Loa (eye worm) hypothetical protein 0.0025 0.0104 0.0426
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0018 0.0047 0.0235
Loa Loa (eye worm) thymidylate kinase 0.0073 0.0483 0.2579
Echinococcus granulosus transcription factor btf3 0.0034 0.0173 0.0366
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0037 0.0201 0.3642
Loa Loa (eye worm) hypothetical protein 0.0053 0.032 0.1656
Trypanosoma brucei retrotransposon hot spot protein 4 (RHS4), interrupted 0.0074 0.049 0.1261
Schistosoma mansoni ap endonuclease 0.0037 0.0201 0.0173
Loa Loa (eye worm) phosphofructokinase 0.0111 0.0776 0.424
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0017 0.004 0.0028
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0037 0.0201 0.0517
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0018 0.0047 0.0047
Onchocerca volvulus 0.0047 0.0274 0.2098
Loa Loa (eye worm) hypothetical protein 0.0018 0.0047 0.0105
Trichomonas vaginalis thymidylate kinase, putative 0.0073 0.0483 0.1242
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0018 0.0047 0.0019
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.003 0.0143 0.1044
Toxoplasma gondii bifunctional dihydrofolate reductase-thymidylate synthase 0.0156 0.1128 1
Onchocerca volvulus 0.0054 0.0328 0.2601
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0019 0.0059 0.0274
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0122 0.0865 0.7614
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0018 0.0047 0.0105
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.0173 0.0446
Plasmodium falciparum glutathione reductase 0.0048 0.0286 0.2345
Echinococcus multilocularis thymidylate kinase 0.0073 0.0483 0.1149
Brugia malayi thymidylate kinase 0.0073 0.0483 0.2676
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0017 0.004 0.0194
Brugia malayi photoreceptor-specific nuclear receptor 0.0018 0.0047 0.0235
Trichomonas vaginalis thymidylate kinase, putative 0.0073 0.0483 0.1242
Loa Loa (eye worm) 6-phosphofructokinase 0.0111 0.0776 0.424
Brugia malayi MH2 domain containing protein 0.0115 0.0812 0.4515
Mycobacterium tuberculosis Hypothetical protein 0.0074 0.0489 0.4188
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0018 0.0047 0.0105
Echinococcus granulosus geminin 0.0521 0.3985 1
Trichomonas vaginalis phosphofructokinase, putative 0.003 0.0143 0.0368
Onchocerca volvulus Putative thymidylate kinase 0.0073 0.0483 0.4036
Loa Loa (eye worm) hypothetical protein 0.0018 0.0047 0.0105
Leishmania major hypothetical protein, conserved 0.0029 0.0134 0.0345
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0018 0.0047 0.0047
Trypanosoma cruzi ATP-dependent 6-phosphofructokinase, glycosomal 0.0111 0.0776 0.1995
Trichomonas vaginalis glutathione reductase, putative 0.0017 0.004 0.0102
Plasmodium falciparum glutathione reductase 0.0017 0.004 0.0102
Plasmodium falciparum bifunctional dihydrofolate reductase-thymidylate synthase 0.0156 0.1128 1
Schistosoma mansoni phosphoglucomutase 0.0066 0.0422 0.0395
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0018 0.0047 0.0105
Trypanosoma brucei unspecified product 0.0074 0.049 0.1261
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.0017 0.004 0.0102
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0017 0.004 0.0102
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0018 0.0047 0.0047
Brugia malayi RNase H family protein 0.0066 0.0422 0.2334
Echinococcus granulosus thymidylate synthase 0.0156 0.1128 0.2778
Onchocerca volvulus 0.0156 0.1128 1
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0026 0.0111 0.0209
Plasmodium falciparum thymidylate kinase 0.0073 0.0483 0.4137
Trichomonas vaginalis phosphofructokinase, putative 0.003 0.0143 0.0368
Trypanosoma cruzi dihydrofolate reductase-thymidylate synthase 0.0156 0.1128 0.2898
Echinococcus granulosus FTZ F1 alpha 0.0018 0.0047 0.0047
Leishmania major acetoin dehydrogenase e3 component-like protein 0.0017 0.004 0.0102
Onchocerca volvulus Ribonuclease H1 homolog 0.0066 0.0422 0.347
Loa Loa (eye worm) hypothetical protein 0.0054 0.0328 0.1699
Echinococcus granulosus ribonuclease H1 0.0066 0.0422 0.0994
Brugia malayi Steroid receptor seven-up type 2 0.0018 0.0047 0.0235
Trypanosoma brucei ingi protein (ORF1) 0.0074 0.049 0.1261
Leishmania major ATP-dependent phosphofructokinase 0.0111 0.0776 0.1995
Trypanosoma cruzi dihydrofolate reductase-thymidylate synthase, putative 0.0074 0.0489 0.1256
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0018 0.0047 0.0235
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0037 0.0201 0.0517
Loa Loa (eye worm) steroid hormone receptor 0.0018 0.0047 0.0105
Schistosoma mansoni survival motor neuron protein 0.0047 0.0274 0.0246
Toxoplasma gondii exonuclease III APE 0.0037 0.0201 0.1615
Entamoeba histolytica hypothetical protein 0.0035 0.0181 0.0465
Brugia malayi exodeoxyribonuclease III family protein 0.0037 0.0201 0.1098
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0037 0.0201 0.0517
Trichomonas vaginalis phosphofructokinase, putative 0.0111 0.0776 0.1995
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0037 0.0201 0.0437
Schistosoma mansoni hypothetical protein 0.0521 0.3985 0.3968
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0054 0.0328 0.1699
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.004 0.0102
Echinococcus granulosus thymidylate kinase 0.0073 0.0483 0.1149
Mycobacterium tuberculosis Probable dehydrogenase 0.011 0.0769 0.674
Schistosoma mansoni hypothetical protein 0.0035 0.0181 0.0153
Brugia malayi glutathione reductase 0.0048 0.0286 0.1574
Leishmania major thymidine kinase, putative 0.0509 0.3891 1
Trypanosoma brucei dihydrofolate reductase-thymidylate synthase 0.0156 0.1128 0.2898
Brugia malayi thymidylate synthase 0.0156 0.1128 0.6284
Plasmodium vivax glutathione reductase, putative 0.0048 0.0286 0.2375
Plasmodium vivax 6-phosphofructokinase, putative 0.003 0.0143 0.108
Echinococcus granulosus intermediate filament protein 0.0054 0.0328 0.0757
Brugia malayi hypothetical protein 0.0035 0.0181 0.0985
Mycobacterium tuberculosis Probable reductase 0.011 0.0769 0.674
Trypanosoma cruzi thymidine kinase, putative 0.0509 0.3891 1
Trichomonas vaginalis phosphofructokinase, putative 0.003 0.0143 0.0368
Brugia malayi beta-NAC-like protein 0.0034 0.0173 0.0942
Echinococcus multilocularis 6 phosphofructokinase 0.0111 0.0776 0.1889
Schistosoma mansoni hypothetical protein 0.0386 0.2933 0.2913
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0018 0.0047 0.0047
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0018 0.0047 0.0019
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.0181 0.0386
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0018 0.0047 0.0235
Treponema pallidum thymidylate kinase (tmk) 0.0073 0.0483 0.6022
Echinococcus multilocularis ribonuclease H1 0.0066 0.0422 0.0994
Toxoplasma gondii thymidylate kinase 0.0073 0.0483 0.4167
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0017 0.004 0.0102
Loa Loa (eye worm) hypothetical protein 0.0018 0.0047 0.0105
Leishmania major trypanothione reductase 0.0048 0.0286 0.0736
Schistosoma mansoni hypothetical protein 0.0047 0.0274 0.0246
Schistosoma mansoni RAR-like nuclear receptor 0.0018 0.0047 0.0019
Entamoeba histolytica hypothetical protein 0.0035 0.0181 0.0465
Echinococcus granulosus survival motor neuron protein 1 0.0228 0.1697 0.4216
Trypanosoma brucei thymidylate kinase, putative 0.0073 0.0483 0.1242
Trypanosoma cruzi ribonuclease H1, putative 0.0066 0.0422 0.1085
Loa Loa (eye worm) intermediate filament protein 0.0054 0.0328 0.1699
Mycobacterium leprae PROBABLE THYMIDYLATE SYNTHASE THYA (TS) (TSASE) 0.0156 0.1128 1
Loa Loa (eye worm) hypothetical protein 0.0017 0.0045 0.0092
Brugia malayi nuclear receptor NHR-88 0.0018 0.0047 0.0235
Giardia lamblia Pyrophosphate-fructose 6-phosphate 1-phosphotransferase alpha subunit 0.003 0.0143 0.0269
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0026 0.0111 0.0209
Echinococcus granulosus lamin dm0 0.0054 0.0328 0.0757
Brugia malayi Bloom's syndrome protein homolog 0.0022 0.0079 0.0415
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0018 0.0047 0.0047
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0037 0.0201 0.1572
Trypanosoma cruzi thymidylate kinase, putative 0.0073 0.0483 0.1242
Schistosoma mansoni thyroid hormone receptor 0.0018 0.0047 0.0019
Echinococcus multilocularis lamin 0.0054 0.0328 0.0757
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0018 0.0047 0.0235
Loa Loa (eye worm) hypothetical protein 0.0228 0.1697 0.9463
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.0017 0.004 0.0102
Trichomonas vaginalis DNA helicase recq1, putative 0.0022 0.0079 0.0204
Echinococcus multilocularis geminin 0.0521 0.3985 1
Leishmania major basic transcription factor 3a, putative 0.0034 0.0173 0.0446
Toxoplasma gondii ribonuclease HI protein 0.0066 0.0422 0.3613
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0018 0.0047 0.0105
Loa Loa (eye worm) hypothetical protein 0.0025 0.0104 0.0426
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0017 0.004 0.0102
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0037 0.0201 0.1572
Schistosoma mansoni ap endonuclease 0.0037 0.0201 0.0173
Mycobacterium tuberculosis Probable thymidylate synthase ThyA (ts) (TSASE) 0.0156 0.1128 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0018 0.0047 0.0105
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0018 0.0047 0.0105
Echinococcus multilocularis thyroid hormone receptor alpha 0.0018 0.0047 0.0047
Chlamydia trachomatis fructose-6-phosphate phosphotransferase 0.003 0.0143 0.2335
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0037 0.0201 0.0517
Mycobacterium ulcerans thymidylate synthase 0.0156 0.1128 1
Trichomonas vaginalis ribonuclease H1, putative 0.0066 0.0422 0.1085
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0018 0.0047 0.0047
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0037 0.0201 0.0437
Leishmania major ribonuclease H1, putative 0.0066 0.0422 0.1085
Loa Loa (eye worm) hypothetical protein 0.0018 0.0047 0.0105
Trypanosoma brucei ATP-dependent 6-phosphofructokinase, glycosomal 0.0111 0.0776 0.1995
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0018 0.0047 0.0047
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.011 0.0769 0.674
Schistosoma mansoni lamin 0.0054 0.0328 0.03
Trypanosoma cruzi UMP-CMP kinase, mitochondrial, putative 0.0029 0.0134 0.0345
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0017 0.004 0.0102
Plasmodium vivax bifunctional dihydrofolate reductase-thymidylate synthase, putative 0.0156 0.1128 1
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0017 0.004 0.0141
Trypanosoma cruzi transcription factor btf3, putative 0.0034 0.0173 0.0446
Loa Loa (eye worm) hypothetical protein 0.0018 0.0047 0.0105
Mycobacterium tuberculosis Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot 0.0017 0.004 0.0102
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.003 0.0143 0.1406
Toxoplasma gondii thioredoxin reductase 0.0048 0.0286 0.2384
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0018 0.0047 0.0235
Schistosoma mansoni steroid hormone receptor ad4bp 0.0018 0.0047 0.0019
Brugia malayi intermediate filament protein 0.0054 0.0328 0.1808
Entamoeba histolytica hypothetical protein 0.0034 0.0173 0.0446
Trypanosoma cruzi thymidine kinase, putative 0.0509 0.3891 1
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0018 0.0047 0.0047
Giardia lamblia Ribonuclease H 0.0066 0.0422 0.0992
Echinococcus multilocularis survival motor neuron protein 1 0.0228 0.1697 0.4216
Trypanosoma brucei thymidylate kinase, putative 0.0073 0.0483 0.1242
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0018 0.0047 0.0047
Brugia malayi ecdysteroid receptor 0.0018 0.0047 0.0235
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0122 0.0865 0.5931
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.004 0.0102
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.011 0.0769 0.674
Plasmodium falciparum basic transcription factor 3b, putative 0.0034 0.0173 0.1318
Schistosoma mansoni hypothetical protein 0.0073 0.0483 0.0456
Schistosoma mansoni hypothetical protein 0.0521 0.3985 0.3968
Trichomonas vaginalis phosphofructokinase, putative 0.003 0.0143 0.0368
Mycobacterium tuberculosis Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase) 0.0111 0.0776 0.6801
Brugia malayi phosphofructokinase 0.0111 0.0776 0.4316
Brugia malayi 6-phosphofructokinase 0.0111 0.0776 0.4316
Loa Loa (eye worm) ICD-1 protein 0.0034 0.0173 0.0822
Echinococcus multilocularis lamin dm0 0.0054 0.0328 0.0757
Entamoeba histolytica hypothetical protein 0.0035 0.0181 0.0465
Loa Loa (eye worm) hypothetical protein 0.0018 0.0047 0.0105
Trypanosoma brucei hypothetical protein, conserved 0.0074 0.049 0.1261
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0017 0.004 0.0011
Loa Loa (eye worm) hypothetical protein 0.0026 0.0111 0.0469
Brugia malayi follicle stimulating hormone receptor 0.0241 0.1792 1
Echinococcus multilocularis musashi 0.0054 0.0328 0.0757
Plasmodium vivax thymidylate kinase, putative 0.0073 0.0483 0.416
Trichomonas vaginalis 6-phosphofructokinase, putative 0.003 0.0143 0.0368
Trypanosoma cruzi trypanothione reductase, putative 0.0017 0.004 0.0102
Treponema pallidum ribonuclease H (rnhA) 0.0066 0.0422 0.5191
Trypanosoma cruzi thymidylate kinase, putative 0.0073 0.0483 0.1242
Chlamydia trachomatis fructose-6-phosphate phosphotransferase 0.003 0.0143 0.2335
Echinococcus multilocularis ecdysone induced protein 78C 0.0018 0.0047 0.0047
Toxoplasma gondii isocitrate dehydrogenase 0.0015 0.0029 0.0052
Entamoeba histolytica Thymidylate kinase, putative 0.0073 0.0483 0.1242
Trypanosoma brucei ribonuclease H1 0.0066 0.0422 0.1085
Schistosoma mansoni nuclear hormone receptor 0.0018 0.0047 0.0019
Trypanosoma cruzi ribonuclease H1, putative 0.0066 0.0422 0.1085
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0018 0.0047 0.0235
Trypanosoma brucei ingi protein (ORF1) 0.0074 0.049 0.1261
Brugia malayi 6-phosphofructokinase 0.0111 0.0776 0.4316
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0037 0.0201 0.1605
Trichomonas vaginalis phosphofructokinase, putative 0.0111 0.0776 0.1995
Echinococcus granulosus bloom syndrome protein 0.0022 0.0079 0.0128
Toxoplasma gondii phosphofructokinase domain-containing protein 0.003 0.0143 0.1091
Brugia malayi hypothetical protein 0.0074 0.0489 0.2708
Schistosoma mansoni thymidylate kinase 0.0073 0.0483 0.0456
Trichomonas vaginalis phosphofructokinase, putative 0.0111 0.0776 0.1995
Entamoeba histolytica pyrophosphate-dependent phosphofructokinase 0.003 0.0143 0.0368
Loa Loa (eye worm) MH2 domain-containing protein 0.0115 0.0812 0.4442
Schistosoma mansoni 6-phosphofructokinase 0.0111 0.0776 0.075
Trichomonas vaginalis thymidine kinase, putative 0.0509 0.3891 1
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0018 0.0047 0.0235
Brugia malayi steroid hormone receptor 0.0018 0.0047 0.0235
Trypanosoma brucei transcription factor BTF3, putative 0.0034 0.0173 0.0446
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0018 0.0047 0.0019
Entamoeba histolytica thymidine kinase, putative 0.0509 0.3891 1
Trichomonas vaginalis mercuric reductase, putative 0.0017 0.004 0.0102
Giardia lamblia CDC8 0.0073 0.0483 0.1151
Plasmodium falciparum thioredoxin reductase 0.0017 0.004 0.0102
Brugia malayi Thioredoxin reductase 0.0048 0.0286 0.1574
Trypanosoma brucei trypanothione reductase 0.0048 0.0286 0.0736
Entamoeba histolytica hypothetical protein 0.0035 0.0181 0.0465
Brugia malayi Nuclear hormone receptor-like 1 0.0018 0.0047 0.0235
Schistosoma mansoni lamin 0.0054 0.0328 0.03
Echinococcus granulosus ecdysone induced protein 78C 0.0018 0.0047 0.0047
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0037 0.0201 0.098
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0018 0.0047 0.0047
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0017 0.004 0.0102
Schistosoma mansoni retinoic acid receptor RXR 0.0018 0.0047 0.0019
Trichomonas vaginalis phosphofructokinase, putative 0.003 0.0143 0.0368
Loa Loa (eye worm) thioredoxin reductase 0.0048 0.0286 0.1462
Loa Loa (eye worm) transcription factor SMAD2 0.0115 0.0812 0.4442
Trichomonas vaginalis thymidine kinase, putative 0.0509 0.3891 1
Echinococcus multilocularis transcription factor btf3 0.0034 0.0173 0.0366
Trichomonas vaginalis thymidine kinase, putative 0.0509 0.3891 1
Schistosoma mansoni family A2 unassigned peptidase (A02 family) 0.0234 0.1744 0.172
Schistosoma mansoni transcription factor btf3 0.0034 0.0173 0.0145
Onchocerca volvulus 0.0054 0.0328 0.2601
Schistosoma mansoni hypothetical protein 0.005 0.03 0.0272
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0018 0.0047 0.0047
Loa Loa (eye worm) 6-phosphofructokinase 0.0111 0.0776 0.424
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0018 0.0047 0.0047
Brugia malayi nuclear hormone receptor 0.0018 0.0047 0.0235
Trichomonas vaginalis ap endonuclease, putative 0.0037 0.0201 0.0517
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0241 0.1792 1
Mycobacterium tuberculosis Probable oxidoreductase 0.0122 0.0865 0.7614
Echinococcus multilocularis bloom syndrome protein 0.0022 0.0079 0.0128
Schistosoma mansoni thyroid hormone receptor 0.0018 0.0047 0.0019
Plasmodium falciparum thioredoxin reductase 0.0048 0.0286 0.2345
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.011 0.0769 0.4441
Echinococcus granulosus 6 phosphofructokinase 0.0111 0.0776 0.1889
Brugia malayi Isocitrate dehydrogenase 0.0015 0.0029 0.0131
Wolbachia endosymbiont of Brugia malayi thymidylate kinase 0.0073 0.0483 1
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.004 0.0102
Leishmania major thymidylate kinase-like protein 0.0073 0.0483 0.1242
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0029 0.0134 0.0596
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0015 0.0029 0.0073
Toxoplasma gondii NAC domain-containing protein 0.0034 0.0173 0.1363
Loa Loa (eye worm) thymidylate synthase 0.0156 0.1128 0.6234
Toxoplasma gondii isocitrate dehydrogenase 0.0015 0.0029 0.0052
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0018 0.0047 0.0235
Mycobacterium ulcerans thymidylate kinase 0.0073 0.0483 0.4076
Entamoeba histolytica phosphofructokinase, putative 0.0111 0.0776 0.1995
Trichomonas vaginalis phosphofructokinase, putative 0.003 0.0143 0.0368
Loa Loa (eye worm) glutathione reductase 0.0048 0.0286 0.1462
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0017 0.004 0.0028
Loa Loa (eye worm) hypothetical protein 0.0018 0.0047 0.0105
Trichomonas vaginalis ap endonuclease, putative 0.0037 0.0201 0.0517
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0018 0.0047 0.0047
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0018 0.0047 0.0235
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0018 0.0047 0.0235
Schistosoma mansoni blooms syndrome DNA helicase 0.0017 0.0043 0.0015
Echinococcus multilocularis thymidylate synthase 0.0156 0.1128 0.2778
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.0181 0.0153
Brugia malayi isocitrate dehydrogenase 0.0015 0.0029 0.0131
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.0181 0.0386
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.004 0.0102
Toxoplasma gondii 6-phosphofructokinase 0.003 0.0143 0.1091
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0122 0.0865 0.7614
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0037 0.0201 0.1485
Echinococcus multilocularis thioredoxin glutathione reductase 0.0048 0.0286 0.0651
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0018 0.0047 0.0019
Echinococcus multilocularis FTZ F1 alpha 0.0018 0.0047 0.0047
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0017 0.004 0.0154
Wolbachia endosymbiont of Brugia malayi ribonuclease HI 0.0066 0.0422 0.8619
Toxoplasma gondii phosphofructokinase PFKII 0.003 0.0143 0.1091
Mycobacterium ulcerans 6-phosphofructokinase 0.0111 0.0776 0.6768
Brugia malayi RNase H family protein 0.0066 0.0422 0.2334
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.004 0.0102
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0015 0.0029 0.0073
Plasmodium vivax 6-phosphofructokinase, putative 0.003 0.0143 0.108
Leishmania major dihydrofolate reductase-thymidylate synthase 0.0156 0.1128 0.2898
Brugia malayi RNase H family protein 0.0066 0.0422 0.2334
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0018 0.0047 0.0105
Trypanosoma cruzi UMP-CMP kinase, mitochondrial, putative 0.0029 0.0134 0.0345
Schistosoma mansoni thymidylate kinase 0.0073 0.0483 0.0456
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0018 0.0047 0.0019
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0017 0.004 0.0102
Mycobacterium tuberculosis Thymidylate kinase Tmk (dTMP kinase) (thymidylic acid kinase) (TMPK) 0.0073 0.0483 0.4137
Mycobacterium tuberculosis Putative ferredoxin reductase 0.011 0.0769 0.674
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0018 0.0047 0.0019
Schistosoma mansoni coup transcription factor 0.0018 0.0047 0.0019
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0015 0.0029 0.0073
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0017 0.004 0.0102
Plasmodium vivax basic transcription factor 3b, putative 0.0034 0.0173 0.1353
Trypanosoma cruzi trypanothione reductase, putative 0.0048 0.0286 0.0736
Schistosoma mansoni phosphoglucomutase 0.0066 0.0422 0.0395
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.004 0.0102
Brugia malayi cytoplasmic intermediate filament protein 0.0029 0.0134 0.0719
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0015 0.0029 0.0073
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.0173 0.0446
Trichomonas vaginalis phosphofructokinase, putative 0.0111 0.0776 0.1995
Schistosoma mansoni intermediate filament proteins 0.0054 0.0328 0.03
Loa Loa (eye worm) RecQ helicase 0.0022 0.0079 0.0288
Echinococcus granulosus lamin 0.0054 0.0328 0.0757

Activities

Activity type Activity value Assay description Source Reference
Ki (binding) = 5 nM Evaluated for binding affinity towards human Cannabinoid receptor 1 ChEMBL. 14980654
Ki (binding) = 5 nM Evaluated for binding affinity towards human Cannabinoid receptor 1 ChEMBL. 14980654

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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