Detailed information for compound 1046876

Basic information

Technical information
  • TDR Targets ID: 1046876
  • Name: 4-[(4aS,5R,9bS)-2-ethyl-7-methyl-1,3,4,4a,5,9 b-hexahydroindeno[3,2-c]pyridin-5-yl]benzoic acid hydrochloride
  • MW: 371.9 | Formula: C22H26ClNO2
  • H donors: 1 H acceptors: 2 LogP: 2.67 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCN1CC[C@@H]2[C@H](C1)c1ccc(cc1[C@H]2c1ccc(cc1)C(=O)O)C.Cl
  • InChi: 1S/C22H25NO2.ClH/c1-3-23-11-10-18-20(13-23)17-9-4-14(2)12-19(17)21(18)15-5-7-16(8-6-15)22(24)25;/h4-9,12,18,20-21H,3,10-11,13H2,1-2H3,(H,24,25);1H/t18-,20-,21+;/m1./s1
  • InChiKey: ZDWZNKMIYHQQKH-CAQXQSSJSA-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
Brugia malayi Carboxylesterase family protein 0.0131 0.0865 0.1601
Schistosoma mansoni hypothetical protein 0.0036 0.0194 0.0194
Echinococcus granulosus Pleckstrin G protein interacting region 0.0009 0.0008 0.0008
Loa Loa (eye worm) carboxylesterase 0.0776 0.5407 1
Echinococcus multilocularis acetylcholinesterase 0.0776 0.5407 0.5407
Schistosoma mansoni aldehyde dehydrogenase 0.006 0.0364 0.0364
Plasmodium falciparum glutathione reductase 0.0047 0.0271 1
Onchocerca volvulus 0.0131 0.0865 0.5399
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0016 0.0056 0.5
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0052 0.031 0.0574
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0011 0.0017 0.0017
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.0364 0.3807
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0039 0.0215 0.0215
Loa Loa (eye worm) acetylcholinesterase 1 0.0776 0.5407 1
Loa Loa (eye worm) hypothetical protein 0.0036 0.0194 0.0358
Toxoplasma gondii NADPH-glutathione reductase 0.0016 0.0056 0.1354
Loa Loa (eye worm) hypothetical protein 0.0233 0.1586 0.2933
Schistosoma mansoni regulator of G protein signaling 0.0009 0.0008 0.0008
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.0364 0.3807
Trypanosoma brucei trypanothione reductase 0.0047 0.0271 1
Schistosoma mansoni microtubule-associated protein tau 0.1428 1 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.0052 0.031 0.0574
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0029 0.0143 0.0143
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0011 0.0017 0.0031
Schistosoma mansoni thyroid hormone receptor 0.0011 0.0017 0.0017
Echinococcus granulosus histone lysine methyltransferase setb 0.003 0.0151 0.0151
Onchocerca volvulus Protein ultraspiracle homolog 0.0011 0.0017 0.0057
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0011 0.0017 0.0031
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0011 0.0017 0.0031
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0011 0.0017 0.0031
Trypanosoma brucei importin beta-1 subunit, putative 0.0028 0.0142 0.4029
Brugia malayi hypothetical protein 0.0233 0.1586 0.2933
Brugia malayi nuclear hormone receptor 0.0011 0.0017 0.0031
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0776 0.5407 0.5407
Loa Loa (eye worm) hypothetical protein 0.0017 0.0059 0.0108
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0011 0.0017 0.0031
Brugia malayi hypothetical protein 0.0039 0.0215 0.0398
Brugia malayi Thioredoxin reductase 0.0047 0.0271 0.0501
Brugia malayi steroid hormone receptor 0.0011 0.0017 0.0031
Schistosoma mansoni BC026374 protein (S09 family) 0.0131 0.0865 0.0865
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0011 0.0017 0.0057
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0304 0.2082 0.385
Loa Loa (eye worm) hypothetical protein 0.0776 0.5407 1
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0011 0.0017 0.0017
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0011 0.0017 0.0017
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0011 0.0017 0.0017
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0011 0.0017 0.0017
Loa Loa (eye worm) latrophilin receptor protein 2 0.0017 0.0059 0.0108
Echinococcus multilocularis BC026374 protein (S09 family) 0.0131 0.0865 0.0865
Toxoplasma gondii HEAT repeat-containing protein 0.0028 0.0142 0.3782
Brugia malayi DIX domain containing protein 0.0009 0.0008 0.0014
Leishmania major trypanothione reductase 0.0047 0.0271 0.697
Loa Loa (eye worm) thioredoxin reductase 0.0047 0.0271 0.0501
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0011 0.0017 0.0017
Trichomonas vaginalis importin beta-1, putative 0.0023 0.0105 0.0316
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0016 0.0056 0.1354
Echinococcus multilocularis regulator of G protein signaling 7 0.0009 0.0008 0.0008
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0011 0.0017 0.0031
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0011 0.0017 0.0017
Schistosoma mansoni neuroligin 3 (S09 family) 0.0131 0.0865 0.0865
Leishmania major importin beta-1 subunit, putative 0.0023 0.0105 0.1578
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0052 0.031 0.0574
Schistosoma mansoni hypothetical protein 0.0017 0.0059 0.0059
Brugia malayi glutathione reductase 0.0047 0.0271 0.0501
Onchocerca volvulus Bile acid receptor homolog 0.0011 0.0017 0.0057
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0016 0.0056 0.5
Echinococcus multilocularis carboxylesterase 5A 0.0776 0.5407 0.5407
Echinococcus granulosus family S9 non peptidase ue S09 family 0.0131 0.0865 0.0865
Echinococcus multilocularis regulator of G protein signaling 7 0.0009 0.0008 0.0008
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0011 0.0017 0.0031
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0011 0.0017 0.0031
Brugia malayi RNA, U transporter 1 0.0081 0.0512 0.0947
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.003 0.0151 0.0151
Plasmodium vivax glutathione reductase, putative 0.0047 0.0271 1
Toxoplasma gondii thioredoxin reductase 0.0047 0.0271 0.738
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.006 0.0364 0.3807
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0011 0.0017 0.0017
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0011 0.0017 0.0031
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0012 0.0026 0.0048
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0131 0.0865 0.0865
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0017 0.0059 0.0108
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0011 0.0017 0.0017
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0011 0.0017 0.0031
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0011 0.0017 0.0031
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.006 0.0364 0.0364
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.003 0.0151 0.0151
Echinococcus granulosus para nitrobenzyl esterase 0.0131 0.0865 0.0865
Loa Loa (eye worm) hypothetical protein 0.0131 0.0865 0.1601
Brugia malayi Pre-SET motif family protein 0.0206 0.1396 0.2581
Echinococcus granulosus GPCR family 2 0.0017 0.0059 0.0059
Brugia malayi MH2 domain containing protein 0.0121 0.0793 0.1466
Schistosoma mansoni transcription factor LCR-F1 0.0039 0.0215 0.0215
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0206 0.1396 0.2581
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0011 0.0017 0.0017
Schistosoma mansoni thyroid hormone receptor 0.0011 0.0017 0.0017
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0151 0.0151
Mycobacterium tuberculosis Probable reductase 0.0106 0.0692 0.7854
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0048 0.0277 0.0513
Echinococcus multilocularis snurportin 1 0.0304 0.2082 0.2082
Plasmodium vivax thioredoxin reductase, putative 0.0047 0.0271 1
Echinococcus granulosus segment polarity protein dishevelled 0.0009 0.0008 0.0008
Plasmodium falciparum importin beta, putative 0.0028 0.0142 0.4029
Brugia malayi Latrophilin receptor protein 2 0.0017 0.0059 0.0108
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0011 0.0017 0.0017
Trypanosoma brucei importin beta-1 subunit, putative 0.0028 0.0142 0.4029
Onchocerca volvulus 0.0131 0.0865 0.5399
Onchocerca volvulus 0.003 0.0151 0.0899
Echinococcus multilocularis importin subunit beta 1 0.0028 0.0142 0.0142
Echinococcus multilocularis acetylcholinesterase 0.0776 0.5407 0.5407
Loa Loa (eye worm) hypothetical protein 0.0011 0.0017 0.0031
Schistosoma mansoni acetylcholinesterase 0.0131 0.0865 0.0865
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0017 0.0059 0.0059
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0131 0.0865 1
Loa Loa (eye worm) hypothetical protein 0.0009 0.0008 0.0014
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0011 0.0017 0.0031
Echinococcus granulosus neuroligin 0.0131 0.0865 0.0865
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0016 0.0056 0.0056
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0011 0.0017 0.0017
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0023 0.0105 0.0316
Schistosoma mansoni coup transcription factor 0.0011 0.0017 0.0017
Brugia malayi Carboxylesterase family protein 0.0776 0.5407 1
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0017 0.0059 0.0059
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0118 0.0775 0.8888
Schistosoma mansoni hypothetical protein 0.0039 0.0215 0.0215
Loa Loa (eye worm) carboxylesterase 0.0131 0.0865 0.1601
Echinococcus granulosus regulator of G protein signaling 7 0.0009 0.0008 0.0008
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0151 0.0151
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0011 0.0017 0.0031
Echinococcus multilocularis segment polarity protein dishevelled 0.0009 0.0008 0.0008
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0011 0.0017 0.0017
Brugia malayi Domain found in Dishevelled, Egl-10, and Pleckstrin family protein 0.0009 0.0008 0.0014
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0039 0.0215 0.0215
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0047 0.0271 0.2653
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0106 0.0692 0.7854
Loa Loa (eye worm) hypothetical protein 0.0131 0.0865 0.1601
Echinococcus multilocularis para nitrobenzyl esterase 0.0131 0.0865 0.0865
Entamoeba histolytica hypothetical protein 0.0039 0.0215 1
Brugia malayi hypothetical protein 0.0131 0.0865 0.1601
Echinococcus granulosus survival motor neuron protein 1 0.0233 0.1586 0.1586
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.006 0.0364 1
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0017 0.0059 0.0059
Loa Loa (eye worm) hypothetical protein 0.0011 0.0017 0.0031
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0011 0.0017 0.0031
Echinococcus multilocularis Pleckstrin G protein, interacting region 0.0009 0.0008 0.0008
Echinococcus multilocularis family S9 non peptidase ue (S09 family) 0.0131 0.0865 0.0865
Trichomonas vaginalis set domain proteins, putative 0.0235 0.1596 1
Brugia malayi Importin beta-1 subunit 0.0028 0.0142 0.0263
Loa Loa (eye worm) hypothetical protein 0.0011 0.0017 0.0031
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0011 0.0017 0.0031
Brugia malayi Steroid receptor seven-up type 2 0.0011 0.0017 0.0031
Brugia malayi latrophilin 2 splice variant baaae 0.0036 0.0194 0.0358
Echinococcus multilocularis microtubule associated protein 2 0.1428 1 1
Brugia malayi regulator of G-protein signaling egl-10 0.0009 0.0008 0.0014
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0011 0.0017 0.0031
Entamoeba histolytica hypothetical protein 0.0039 0.0215 1
Echinococcus granulosus regulator of G protein signaling 7 0.0009 0.0008 0.0008
Brugia malayi Carboxylesterase family protein 0.0131 0.0865 0.1601
Plasmodium vivax SET domain protein, putative 0.003 0.0151 0.4404
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0011 0.0017 0.0031
Loa Loa (eye worm) hypothetical protein 0.0009 0.0008 0.0014
Loa Loa (eye worm) hypothetical protein 0.0028 0.0142 0.0263
Schistosoma mansoni aldehyde dehydrogenase 0.006 0.0364 0.0364
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0011 0.0017 0.0017
Schistosoma mansoni nuclear hormone receptor 0.0011 0.0017 0.0017
Loa Loa (eye worm) hypothetical protein 0.0131 0.0865 0.1601
Loa Loa (eye worm) steroid hormone receptor 0.0011 0.0017 0.0031
Echinococcus multilocularis GPCR, family 2 0.0017 0.0059 0.0059
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0016 0.0056 0.0056
Loa Loa (eye worm) glutathione reductase 0.0047 0.0271 0.0501
Onchocerca volvulus 0.0235 0.1596 1
Mycobacterium tuberculosis Carboxylesterase LipT 0.0131 0.0865 1
Echinococcus multilocularis thyroid hormone receptor alpha 0.0011 0.0017 0.0017
Schistosoma mansoni hypothetical protein 0.0017 0.0059 0.0059
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0011 0.0017 0.0017
Loa Loa (eye worm) hypothetical protein 0.0189 0.1275 0.2358
Trypanosoma cruzi trypanothione reductase, putative 0.0047 0.0271 1
Brugia malayi photoreceptor-specific nuclear receptor 0.0011 0.0017 0.0031
Echinococcus multilocularis ecdysone induced protein 78C 0.0011 0.0017 0.0017
Plasmodium vivax importin-beta 2, putative 0.0028 0.0142 0.4029
Loa Loa (eye worm) carboxylesterase 0.0131 0.0865 0.1601
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0131 0.0865 0.0865
Echinococcus granulosus BC026374 protein S09 family 0.0131 0.0865 0.0865
Brugia malayi Carboxylesterase family protein 0.0131 0.0865 0.1601
Onchocerca volvulus 0.0131 0.0865 0.5399
Loa Loa (eye worm) hypothetical protein 0.0052 0.031 0.0574
Schistosoma mansoni z-protein (S1r protein) 0.0009 0.0008 0.0008
Schistosoma mansoni RAR-like nuclear receptor 0.0011 0.0017 0.0017
Brugia malayi ecdysteroid receptor 0.0011 0.0017 0.0031
Giardia lamblia NADH oxidase lateral transfer candidate 0.0016 0.0056 0.5
Echinococcus granulosus snurportin 1 0.0304 0.2082 0.2082
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0118 0.0775 1
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.003 0.0151 0.4008
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0106 0.0692 0.7854
Loa Loa (eye worm) DIX domain-containing protein 0.0009 0.0008 0.0014
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0118 0.0775 0.8888
Loa Loa (eye worm) hypothetical protein 0.0131 0.0865 0.1601
Trichomonas vaginalis spcc417.12 protein, putative 0.0131 0.0865 0.5255
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0017 0.0059 0.0059
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0106 0.0692 0.7854
Brugia malayi Pre-SET motif family protein 0.003 0.0151 0.0278
Loa Loa (eye worm) hypothetical protein 0.0011 0.0017 0.0031
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0016 0.0056 0.5
Echinococcus granulosus FTZ F1 alpha 0.0011 0.0017 0.0017
Schistosoma mansoni retinoic acid receptor RXR 0.0011 0.0017 0.0017
Loa Loa (eye worm) hypothetical protein 0.0011 0.0017 0.0031
Echinococcus granulosus thioredoxin glutathione reductase 0.0047 0.0271 0.0271
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0011 0.0017 0.0031
Entamoeba histolytica hypothetical protein 0.0039 0.0215 1
Loa Loa (eye worm) hypothetical protein 0.0131 0.0865 0.1601
Loa Loa (eye worm) hypothetical protein 0.0776 0.5407 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.0364 0.3807
Loa Loa (eye worm) hypothetical protein 0.003 0.0151 0.0278
Loa Loa (eye worm) hypothetical protein 0.0131 0.0865 0.1601
Onchocerca volvulus 0.0011 0.0017 0.0057
Loa Loa (eye worm) hypothetical protein 0.0131 0.0865 0.1601
Entamoeba histolytica hypothetical protein 0.0039 0.0215 1
Brugia malayi hypothetical protein 0.0009 0.0008 0.0014
Brugia malayi nuclear receptor NHR-88 0.0011 0.0017 0.0031
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.003 0.0151 0.0151
Loa Loa (eye worm) hypothetical protein 0.0011 0.0017 0.0031
Echinococcus granulosus carboxylesterase 5A 0.0776 0.5407 0.5407
Trypanosoma cruzi importin beta-1 subunit, putative 0.0023 0.0105 0.2264
Loa Loa (eye worm) hypothetical protein 0.0009 0.0008 0.0014
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0011 0.0017 0.0017
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0011 0.0017 0.0017
Brugia malayi Carboxylesterase family protein 0.0776 0.5407 1
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.006 0.0364 0.0364
Loa Loa (eye worm) hypothetical protein 0.0011 0.0017 0.0031
Brugia malayi N-terminal motif family protein 0.0189 0.1275 0.2358
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0011 0.0017 0.0017
Plasmodium falciparum thioredoxin reductase 0.0047 0.0271 1
Echinococcus multilocularis neuroligin 0.0131 0.0865 0.0865
Schistosoma mansoni hypothetical protein 0.0017 0.0059 0.0059
Mycobacterium tuberculosis Probable dehydrogenase 0.0106 0.0692 0.7854
Loa Loa (eye worm) G protein signaling regulator EGL-10 0.0009 0.0008 0.0014
Loa Loa (eye worm) hypothetical protein 0.0011 0.0017 0.0031
Onchocerca volvulus 0.0131 0.0865 0.5399
Brugia malayi Domain found in Dishevelled, Egl-10, and Pleckstrin family protein 0.0009 0.0008 0.0014
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0016 0.0056 0.0103
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0011 0.0017 0.0031
Schistosoma mansoni hypothetical protein 0.0304 0.2082 0.2082
Mycobacterium ulcerans carboxylesterase, LipT 0.0131 0.0865 1
Trichomonas vaginalis carboxylesterase domain containing protein, putative 0.0131 0.0865 0.5255
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0011 0.0017 0.0017
Schistosoma mansoni hypothetical protein 0.0017 0.0059 0.0059
Schistosoma mansoni hypothetical protein 0.0048 0.0277 0.0277
Schistosoma mansoni dishevelled 0.0009 0.0008 0.0008
Echinococcus granulosus ecdysone induced protein 78C 0.0011 0.0017 0.0017
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0131 0.0865 0.0865
Schistosoma mansoni dishevelled 0.0009 0.0008 0.0008
Echinococcus granulosus acetylcholinesterase 0.0776 0.5407 0.5407
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0011 0.0017 0.0031
Echinococcus granulosus importin subunit beta 1 0.0028 0.0142 0.0142
Mycobacterium tuberculosis Probable oxidoreductase 0.0118 0.0775 0.8888
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0016 0.0056 0.0056
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0131 0.0865 1
Loa Loa (eye worm) transcription factor SMAD2 0.0121 0.0793 0.1466
Echinococcus multilocularis survival motor neuron protein 1 0.0233 0.1586 0.1586
Brugia malayi Nuclear hormone receptor-like 1 0.0011 0.0017 0.0031
Loa Loa (eye worm) MH2 domain-containing protein 0.0121 0.0793 0.1466
Schistosoma mansoni fyve finger-containing phosphoinositide kinase fyv1 0.0009 0.0008 0.0008
Echinococcus multilocularis FTZ F1 alpha 0.0011 0.0017 0.0017
Schistosoma mansoni gliotactin 0.0131 0.0865 0.0865
Echinococcus granulosus segment polarity protein dishevelled 0.0009 0.0008 0.0008
Echinococcus multilocularis thioredoxin glutathione reductase 0.0047 0.0271 0.0271
Schistosoma mansoni importin beta-1 0.0028 0.0142 0.0142
Echinococcus granulosus acetylcholinesterase 0.0776 0.5407 0.5407
Toxoplasma gondii aldehyde dehydrogenase 0.006 0.0364 1
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0106 0.0692 0.7854
Onchocerca volvulus 0.0131 0.0865 0.5399
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0023 0.0105 0.0316
Echinococcus multilocularis segment polarity protein dishevelled 0.0009 0.0008 0.0008
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0189 0.1275 0.7978
Schistosoma mansoni steroid hormone receptor ad4bp 0.0011 0.0017 0.0017
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0151 0.0151
Onchocerca volvulus 0.0048 0.0277 0.1697
Treponema pallidum NADH oxidase 0.0016 0.0056 0.5
Brugia malayi Carboxylesterase family protein 0.0131 0.0865 0.1601
Brugia malayi hypothetical protein 0.0009 0.0008 0.0014
Schistosoma mansoni survival motor neuron protein 0.0048 0.0277 0.0277
Schistosoma mansoni dep domain containing protein 0.0009 0.0008 0.0008
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0012 0.0026 0.0048

Activities

Activity type Activity value Assay description Source Reference
Reduction (functional) = -7 % Tested for its effect on testes weight 3 days after single oral dose (90 mg/kg) ChEMBL. 7877141
Reduction (functional) = -5 % Tested for its effect on testes weight 3 days after single oral dose (3 mg/kg) ChEMBL. 7877141
Reduction (functional) = -3 % Tested for its effect on testes weight 3 days after single sub cutaneous (10 mg/kg) ChEMBL. 7877141
Reduction (functional) = 0 % Tested for its effect on spermatogenic index 3 days after single oral dose (90 mg/kg) ChEMBL. 7877141
Reduction (functional) = 2 % Tested for its effect on spermatogenic index 3 days after single oral dose (3 mg/kg) , ChEMBL. 7877141
Reduction (functional) = 5 % Tested for its effect on testes weight 3 days after single sub cutaneous dose (3 mg/kg) ChEMBL. 7877141
Reduction (functional) = 8 % Tested for its effect on spermatogenic index 3 days after single sub cutaneous dose (3 mg/kg) ChEMBL. 7877141
Reduction (functional) = 13 % Tested for its effect on testes weight 3 days after single oral dose (3 mg/kg) ChEMBL. 7877141
Reduction (functional) = 16 % Tested for its effect on testes weight 3 days after single oral dose (30 mg/kg) ChEMBL. 7877141
Reduction (functional) = 17 % Tested for its effect on testes weight 3 days after single single sub cutaneous dose (30 mg/kg) ChEMBL. 7877141
Reduction (functional) = 21 % Tested for its effect on spermatogenic index 3 days after single oral dose (3 mg/kg) ChEMBL. 7877141
Reduction (functional) = 24 % Tested for its effect on testes weight 3 days after single oral dose (10 mg/kg) ChEMBL. 7877141
Reduction (functional) = 26 % Tested for its effect on testes weight 3 days after single oral dose (10 mg/kg) ChEMBL. 7877141
Reduction (functional) = 27 % Tested for its effect on testes weight 3 days after single oral dose (90 mg/kg) ChEMBL. 7877141
Reduction (functional) = 27 % Tested for its effect on spermatogenic index 3 days after single sub cutaneous dose (10 mg/kg) ChEMBL. 7877141
Reduction (functional) = 28 % Tested for its effect on testes weight 3 days after single oral dose (30 mg/kg) ChEMBL. 7877141
Reduction (functional) = 35 % Tested for its effect on spermatogenic index 3 days after single oral dose (30 mg/kg) ChEMBL. 7877141
Reduction (functional) = 36 % Tested for its effect on spermatogenic index 3 days after single oral dose (10 mg/kg) ChEMBL. 7877141
Reduction (functional) = 40 % Tested for its effect on spermatogenic index 3 days after single oral dose (10 mg/kg) ChEMBL. 7877141
Reduction (functional) = 51 % Tested for its effect on spermatogenic index 3 days after single oral dose (30 mg/kg) ChEMBL. 7877141
Reduction (functional) = 67 % Tested for its effect on spermatogenic index 3 days after single oral dose (30 mg/kg) ChEMBL. 7877141
Reduction (functional) = 70 % Tested for its effect on spermatogenic index 3 days after single oral dose (90 mg/kg) ChEMBL. 7877141

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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