Detailed information for compound 1024870

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 293.835 | Formula: C16H24ClN3
  • H donors: 1 H acceptors: 1 LogP: 4.34 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(Cc1cnc(n1CCCc1ccccc1)N)C.Cl
  • InChi: 1S/C16H23N3.ClH/c1-13(2)11-15-12-18-16(17)19(15)10-6-9-14-7-4-3-5-8-14;/h3-5,7-8,12-13H,6,9-11H2,1-2H3,(H2,17,18);1H
  • InChiKey: PXROCGSFYUXJKI-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
Schistosoma mansoni peptidase Clp (S14 family) 0.0083 0.2969 0.2942
Toxoplasma gondii NADPH-glutathione reductase 0.0013 0.0347 0.0709
Echinococcus multilocularis tar DNA binding protein 0.027 1 1
Brugia malayi Nuclear hormone receptor family member nhr-40 0.002 0.0608 0.0595
Entamoeba histolytica exodeoxyribonuclease III, putative 0.004 0.1353 1
Echinococcus granulosus CCR4 NOT transcription complex subunit 6 0.0008 0.0147 0.0109
Echinococcus granulosus traf and tnf receptor associated protein 0.0008 0.0147 0.0109
Loa Loa (eye worm) endonuclease/Exonuclease/phosphatase 0.0008 0.0147 0.0133
Brugia malayi Bromodomain containing protein 0.0005 0.0038 0.0024
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0013 0.0347 0.1659
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0008 0.0147 0.0109
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0146 0.5325 0.5307
Brugia malayi tailless protein 0.001 0.0203 0.0189
Brugia malayi exodeoxyribonuclease III family protein 0.004 0.1353 0.1341
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0008 0.0147 0.0133
Schistosoma mansoni smad1 5 8 and 0.0008 0.0154 0.0116
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.0054 0.1892 0.3712
Loa Loa (eye worm) hypothetical protein 0.0083 0.2969 0.2959
Trichomonas vaginalis Phospholipase C precursor, putative 0.0008 0.0147 0.0432
Brugia malayi Nuclear hormone receptor family member nhr-49 0.002 0.0608 0.0595
Onchocerca volvulus 0.0029 0.0928 1
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.002 0.0608 0.0572
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0013 0.0347 0.1659
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.001 0.0203 0.0721
Loa Loa (eye worm) nuclear receptor NHR-67 0.001 0.0203 0.0189
Trichomonas vaginalis carbon catabolite repressor protein, putative 0.0008 0.0147 0.0432
Onchocerca volvulus Bile acid receptor homolog 0.002 0.0608 0.5902
Loa Loa (eye worm) hypothetical protein 0.0011 0.0247 0.0233
Loa Loa (eye worm) CCR4-NOT transcription complex subunit 6 family protein 0.0008 0.0147 0.0133
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.002 0.0608 0.0595
Brugia malayi hypothetical protein 0.001 0.0203 0.0189
Echinococcus granulosus inositol polyphosphate 5 phosphatase OCRL 1 0.0008 0.0147 0.0109
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.0178 0.014
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0013 0.0347 0.0416
Echinococcus multilocularis neutral sphingomyelinase 0.0008 0.0147 0.0109
Loa Loa (eye worm) transcription factor SMAD2 0.0121 0.4416 0.4408
Loa Loa (eye worm) MH2 domain-containing protein 0.0008 0.0154 0.014
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0088 0.3167 0.8583
Brugia malayi Nuclear hormone receptor E75 0.001 0.0203 0.0189
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0043 0.1454 0.4633
Brugia malayi nuclear receptor NHR-67 0.001 0.0203 0.0189
Trichomonas vaginalis carbon catabolite repressor protein, putative 0.0008 0.0147 0.0432
Schistosoma mansoni zinc finger protein 0.001 0.0203 0.0166
Onchocerca volvulus 0.001 0.0203 0.0721
Loa Loa (eye worm) glutathione reductase 0.0039 0.13 0.1287
Loa Loa (eye worm) MH2 domain-containing protein 0.0121 0.4416 0.4408
Schistosoma mansoni hypothetical protein 0.0039 0.1319 0.1285
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0007 0.0112 0.0074
Trypanosoma brucei peptidyl-prolyl cis-trans isomerase/rotamase, putative 0.0033 0.1099 0.7891
Echinococcus multilocularis geminin 0.018 0.6618 0.6605
Brugia malayi steroid hormone receptor 0.002 0.0608 0.0595
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0011 0.0247 0.0209
Trichomonas vaginalis carbon catabolite repressor protein, putative 0.0008 0.0147 0.0432
Loa Loa (eye worm) hypothetical protein 0.001 0.0203 0.0189
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0083 0.2969 0.7826
Loa Loa (eye worm) TAR-binding protein 0.027 1 1
Treponema pallidum exodeoxyribonuclease (exoA) 0.004 0.1353 0.4274
Entamoeba histolytica hypothetical protein 0.0039 0.1319 0.9714
Echinococcus granulosus neutral sphingomyelinase 0.0008 0.0147 0.0109
Plasmodium vivax exodeoxyribonuclease III, putative 0.0008 0.0147 0.0495
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0088 0.3167 0.8906
Trypanosoma cruzi trypanothione reductase, putative 0.0013 0.0347 0.1659
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.0054 0.1892 0.5144
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0013 0.0347 0.1659
Schistosoma mansoni Smad4 0.0008 0.0154 0.0116
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0013 0.0347 0.0333
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0007 0.0112 0.0074
Echinococcus granulosus ecdysone induced protein 78C 0.002 0.0608 0.0572
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase 0.001 0.0233 0.0715
Loa Loa (eye worm) hypothetical protein 0.001 0.0203 0.0189
Echinococcus multilocularis ecdysone induced protein 78C 0.002 0.0608 0.0572
Loa Loa (eye worm) hypothetical protein 0.001 0.0203 0.0189
Toxoplasma gondii hypothetical protein 0.0029 0.0919 0.2737
Schistosoma mansoni tar DNA-binding protein 0.027 1 1
Echinococcus multilocularis deoxyribonuclease 1 2 0.0008 0.0147 0.0109
Schistosoma mansoni ap endonuclease 0.004 0.1353 0.132
Brugia malayi nuclear hormone receptor 0.001 0.0203 0.0189
Loa Loa (eye worm) hypothetical protein 0.002 0.0608 0.0595
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.002 0.0608 0.0572
Brugia malayi Nuclear hormone receptor-like 1 0.002 0.0608 0.0595
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase, putative 0.001 0.0233 0.0715
Trypanosoma brucei trypanothione reductase 0.0039 0.13 0.9557
Mycobacterium tuberculosis Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot 0.0013 0.0347 0.059
Loa Loa (eye worm) hypothetical protein 0.001 0.0203 0.0189
Plasmodium vivax hypothetical protein, conserved 0.0008 0.0147 0.0495
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.004 0.1353 0.132
Echinococcus multilocularis expressed protein 0.0034 0.1129 0.1095
Plasmodium vivax thioredoxin reductase, putative 0.0039 0.13 0.4378
Schistosoma mansoni nocturnin 0.0008 0.0147 0.0109
Brugia malayi nuclear receptor NHR-88 0.002 0.0608 0.0595
Schistosoma mansoni cpg binding protein 0.003 0.099 0.0956
Echinococcus granulosus thioredoxin glutathione reductase 0.0039 0.1319 0.1286
Brugia malayi Nuclear hormone receptor family member nhr-25 0.002 0.0608 0.0595
Schistosoma mansoni nuclear hormone receptor 0.001 0.0203 0.0166
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0083 0.2969 1
Loa Loa (eye worm) hypothetical protein 0.002 0.0608 0.0595
Loa Loa (eye worm) hypothetical protein 0.0005 0.0038 0.0024
Brugia malayi Probable ClpP-like protease 0.0083 0.2969 0.2959
Loa Loa (eye worm) Pin1-type peptidyl-prolyl cis-trans isomerase 0.0034 0.1129 0.1116
Loa Loa (eye worm) hypothetical protein 0.0005 0.0038 0.0024
Trichomonas vaginalis ap endonuclease, putative 0.004 0.1353 0.926
Brugia malayi nuclear receptor NHR-88 0.001 0.0203 0.0189
Brugia malayi Nuclear hormone receptor family member nhr-1 0.002 0.0608 0.0595
Echinococcus multilocularis synaptojanin 1 0.0008 0.0147 0.0109
Leishmania major peptidyl-prolyl cis-trans isomerase, putative 0.001 0.0233 0.0715
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0013 0.0347 0.1659
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.004 0.1353 0.132
Echinococcus multilocularis Smad4 0.0008 0.0154 0.0116
Trichomonas vaginalis type IV inositol 5-phosphatase, putative 0.0008 0.0147 0.0432
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0083 0.2969 1
Brugia malayi Nuclear hormone receptor family member nhr-14 0.002 0.0608 0.0595
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.002 0.0608 0.0572
Mycobacterium tuberculosis Probable oxidoreductase 0.0098 0.3538 1
Loa Loa (eye worm) hypothetical protein 0.001 0.0203 0.0189
Giardia lamblia NADH oxidase lateral transfer candidate 0.0013 0.0347 0.1659
Plasmodium falciparum histone acetyltransferase GCN5 0.0039 0.132 0.4157
Brugia malayi Smad1 0.0008 0.0154 0.014
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.002 0.0608 0.0572
Schistosoma mansoni synaptojanin 0.0008 0.0147 0.0109
Echinococcus granulosus retinoic acid receptor rxr beta a 0.002 0.0608 0.0572
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0096 0.345 0.3425
Echinococcus multilocularis inositol polyphosphate 5 phosphatase OCRL 1 0.0008 0.0147 0.0109
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.0013 0.0347 0.0709
Loa Loa (eye worm) hypothetical protein 0.002 0.0608 0.0595
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0011 0.0247 0.0209
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0011 0.0247 0.0233
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0083 0.2969 1
Loa Loa (eye worm) hypothetical protein 0.0011 0.0247 0.0233
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0029 0.0919 0.3096
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.1129 0.762
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.002 0.0608 0.0572
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0088 0.3167 0.8906
Loa Loa (eye worm) RNA binding protein 0.027 1 1
Schistosoma mansoni retinoid-x-receptor (RXR) 0.002 0.0608 0.0572
Schistosoma mansoni tar DNA-binding protein 0.027 1 1
Brugia malayi acetyltransferase, GNAT family protein 0.0146 0.5325 0.5318
Brugia malayi Nuclear hormone receptor family member nhr-19 0.002 0.0608 0.0595
Echinococcus multilocularis CCR4 NOT transcription complex subunit 6 0.0008 0.0147 0.0109
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0203 0.0166
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.002 0.0608 0.0572
Echinococcus granulosus synaptojanin 1 0.0008 0.0147 0.0109
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0007 0.0112 0.0074
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0083 0.2969 0.2942
Echinococcus granulosus mothers against decapentaplegic 5 0.0008 0.0154 0.0116
Entamoeba histolytica acetyltransferase, GNAT family 0.0039 0.132 0.9724
Schistosoma mansoni nuclear receptor 0.001 0.0203 0.0166
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0013 0.0347 0.1659
Onchocerca volvulus Protein ultraspiracle homolog 0.002 0.0608 0.5902
Trichomonas vaginalis bromodomain-containing protein, putative 0.0043 0.1454 1
Loa Loa (eye worm) endonuclease/Exonuclease/phosphatase 0.0008 0.0147 0.0133
Mycobacterium tuberculosis Probable reductase 0.0088 0.3167 0.8906
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.001 0.0203 0.0166
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.002 0.0608 0.0595
Echinococcus multilocularis nuclear receptor nhr 48 0.001 0.0203 0.0166
Schistosoma mansoni hypothetical protein 0.018 0.6618 0.6605
Loa Loa (eye worm) nuclear hormone receptor 0.001 0.0203 0.0189
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0008 0.0147 0.0109
Brugia malayi F/Y-rich N-terminus family protein 0.0009 0.0174 0.016
Loa Loa (eye worm) histone methyltransferase 0.0009 0.0178 0.0164
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.004 0.1353 0.3837
Echinococcus granulosus histone acetyltransferase KAT2B 0.0043 0.1454 0.1422
Schistosoma mansoni nuclear receptor nhr-48 0.001 0.0203 0.0166
Plasmodium falciparum thioredoxin reductase 0.0013 0.0347 0.0709
Plasmodium vivax glutathione reductase, putative 0.0039 0.13 0.4378
Loa Loa (eye worm) DR-78 0.001 0.0203 0.0189
Toxoplasma gondii peptidylprolyl isomerase 0.0033 0.1099 0.3373
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0013 0.0347 0.1659
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0008 0.0154 0.0116
Echinococcus multilocularis cpg binding protein 0.003 0.099 0.0956
Brugia malayi photoreceptor-specific nuclear receptor 0.002 0.0608 0.0595
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0061 0.2146 0.2116
Echinococcus multilocularis Nuclear hormone receptor HR96 0.001 0.0203 0.0166
Schistosoma mansoni smad1 5 8 and 0.0008 0.0154 0.0116
Trichomonas vaginalis glutathione reductase, putative 0.0013 0.0347 0.1896
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0008 0.0147 0.0133
Schistosoma mansoni steroid hormone receptor ad4bp 0.002 0.0608 0.0572
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0029 0.0919 0.2737
Plasmodium falciparum glutathione reductase 0.0039 0.13 0.4085
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.001 0.0203 0.0166
Loa Loa (eye worm) hypothetical protein 0.0011 0.0247 0.0233
Echinococcus granulosus thyroid hormone receptor alpha 0.001 0.0203 0.0166
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0013 0.0347 0.1659
Mycobacterium tuberculosis Probable dehydrogenase 0.0088 0.3167 0.8906
Echinococcus multilocularis FTZ F1 alpha 0.002 0.0608 0.0572
Schistosoma mansoni retinoic acid receptor RXR 0.002 0.0608 0.0572
Schistosoma mansoni rotamase 0.0034 0.1129 0.1095
Brugia malayi orphan nuclear receptor NR2E1 0.001 0.0203 0.0189
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0008 0.0147 0.0133
Echinococcus granulosus smad 0.0008 0.0154 0.0116
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0013 0.0347 0.0416
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0096 0.345 0.3425
Trichomonas vaginalis mercuric reductase, putative 0.0013 0.0347 0.1896
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0083 0.2969 1
Trypanosoma cruzi trypanothione reductase, putative 0.0039 0.13 0.9557
Brugia malayi MH2 domain containing protein 0.0008 0.0154 0.014
Brugia malayi nuclear hormone receptor family member nhr-6 0.001 0.0203 0.0189
Schistosoma mansoni synaptojanin 0.0008 0.0147 0.0109
Loa Loa (eye worm) thioredoxin reductase 0.0039 0.13 0.1287
Echinococcus multilocularis Nuclear hormone receptor HR96 0.001 0.0203 0.0166
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.002 0.0608 0.0595
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.002 0.0608 0.0572
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0083 0.2969 1
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.001 0.0203 0.0166
Echinococcus granulosus nuclear receptor 2DBD gamma 0.002 0.0608 0.0572
Brugia malayi Nuclear hormone receptor-like 1 0.0011 0.0247 0.0233
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0083 0.2969 1
Brugia malayi TAR-binding protein 0.027 1 1
Echinococcus granulosus histone acetyltransferase KAT2B 0.0142 0.5171 0.5153
Schistosoma mansoni ocrl type II inositol 5-phosphatase 0.0008 0.0147 0.0109
Brugia malayi Nuclear hormone receptor family member nhr-3 0.002 0.0608 0.0595
Echinococcus granulosus nuclear receptor 2DBD gamma 0.002 0.0608 0.0572
Loa Loa (eye worm) hypothetical protein 0.0008 0.0147 0.0133
Loa Loa (eye worm) nuclear receptor nhr-7B 0.001 0.0203 0.0189
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.004 0.1353 0.3557
Trichomonas vaginalis type II inositol 5-phosphatase, putative 0.0008 0.0147 0.0432
Echinococcus granulosus Smad4 0.0008 0.0154 0.0116
Schistosoma mansoni cpg binding protein 0.0029 0.0928 0.0894
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0013 0.0347 0.1169
Echinococcus granulosus TGF beta signal transducer SmadC 0.0008 0.0154 0.0116
Toxoplasma gondii thioredoxin reductase 0.0039 0.13 0.4085
Schistosoma mansoni hypothetical protein 0.018 0.6618 0.6605
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.002 0.0608 0.0572
Schistosoma mansoni cpg binding protein 0.003 0.099 0.0956
Schistosoma mansoni thyroid hormone receptor 0.002 0.0608 0.0572
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0083 0.2969 1
Schistosoma mansoni smad 0.0008 0.0154 0.0116
Brugia malayi glutathione reductase 0.0039 0.13 0.1287
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0083 0.2969 1
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0008 0.0154 0.0116
Brugia malayi Nuclear hormone receptor-like 1 0.0011 0.0247 0.0233
Schistosoma mansoni RAR-like nuclear receptor 0.002 0.0608 0.0572
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0008 0.0147 0.0133
Loa Loa (eye worm) hypothetical protein 0.002 0.0608 0.0595
Echinococcus multilocularis smad 0.0008 0.0154 0.0116
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0098 0.3538 1
Schistosoma mansoni nuclear receptor 0.001 0.0203 0.0166
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0083 0.2969 0.2942
Trichomonas vaginalis sphingomyelinase C 2 precursor, putative 0.0008 0.0147 0.0432
Brugia malayi nuclear hormone receptor 0.002 0.0608 0.0595
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0007 0.0112 0.0074
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.002 0.0608 0.0572
Schistosoma mansoni tar DNA-binding protein 0.027 1 1
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.004 0.1353 1
Schistosoma mansoni ap endonuclease 0.004 0.1353 0.132
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0013 0.0347 0.1659
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.0178 0.014
Loa Loa (eye worm) hypothetical protein 0.0008 0.0147 0.0133
Schistosoma mansoni coup transcription factor 0.002 0.0608 0.0572
Echinococcus granulosus mixed lineage leukemia protein mll 0.0007 0.0112 0.0074
Trichomonas vaginalis skeletal muscle/kidney enriched inositol 5-phosphatase, putative 0.0008 0.0147 0.0432
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.027 1 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.002 0.0608 0.0595
Schistosoma mansoni neutral sphingomyelinase 0.0008 0.0147 0.0109
Trypanosoma brucei peptidyl-prolyl cis-trans isomerase, putative 0.001 0.0233 0.0715
Toxoplasma gondii exonuclease III APE 0.004 0.1353 0.4274
Plasmodium falciparum glutathione reductase 0.0013 0.0347 0.0709
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.004 0.1353 1
Loa Loa (eye worm) hypothetical protein 0.0011 0.0247 0.0233
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0011 0.0247 0.0209
Brugia malayi Thioredoxin reductase 0.0039 0.13 0.1287
Echinococcus multilocularis peptidase Clp (S14 family) 0.0054 0.1892 0.1861
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0088 0.3167 0.8906
Plasmodium vivax endonuclease/exonuclease/phosphatase domain containing protein 0.0008 0.0147 0.0495
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0011 0.0247 0.0209
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.001 0.0203 0.0189
Plasmodium vivax endonuclease/exonuclease/phosphatase domain containing protein 0.0008 0.0147 0.0495
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0096 0.345 0.3441
Loa Loa (eye worm) endonuclease/Exonuclease/phosphatase 0.0008 0.0147 0.0133
Brugia malayi Pin1-type peptidyl-prolyl cis-trans isomerase, BmPin1 0.0034 0.1129 0.1116
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0008 0.0147 0.0133
Loa Loa (eye worm) hypothetical protein 0.001 0.0203 0.0189
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0083 0.2969 1
Echinococcus granulosus Nuclear hormone receptor HR96 0.001 0.0203 0.0166
Echinococcus granulosus FTZ F1 alpha 0.002 0.0608 0.0572
Loa Loa (eye worm) hypothetical protein 0.001 0.0203 0.0189
Schistosoma mansoni carbon catabolite repressor protein 0.0008 0.0147 0.0109
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0013 0.0347 0.1169
Echinococcus granulosus peptidase Clp S14 family 0.0054 0.1892 0.1861
Onchocerca volvulus 0.001 0.0203 0.0721
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.002 0.0608 0.0595
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.002 0.0608 0.0595
Schistosoma mansoni hypothetical protein 0.0008 0.0147 0.0109
Loa Loa (eye worm) CXXC zinc finger family protein 0.0029 0.0928 0.0915
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.004 0.1353 0.1341
Trichomonas vaginalis ocrl type II inositol 5-phosphatase, putative 0.0008 0.0147 0.0432
Schistosoma mansoni Tr4/Tr2 (homologue) 0.002 0.0608 0.0572
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.004 0.1353 1
Schistosoma mansoni transcription factor LCR-F1 0.0039 0.1319 0.1285
Brugia malayi Nuclear hormone receptor E75 0.001 0.0203 0.0189
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.0013 0.0347 0.0709
Brugia malayi Nuclear hormone receptor family member nhr-41 0.002 0.0608 0.0595
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0088 0.3167 0.8906
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0013 0.0347 0.1659
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0029 0.0919 0.2737
Schistosoma mansoni smad1 5 8 and 0.0008 0.0154 0.0116
Loa Loa (eye worm) hypothetical protein 0.001 0.0203 0.0189
Giardia lamblia Histone acetyltransferase GCN5 0.0039 0.132 0.9724
Treponema pallidum NADH oxidase 0.0013 0.0347 0.0709
Loa Loa (eye worm) hypothetical protein 0.0008 0.0147 0.0133
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0096 0.345 0.3425
Toxoplasma gondii PPIC-type PPIASE domain-containing protein 0.001 0.0233 0.0306
Echinococcus granulosus geminin 0.018 0.6618 0.6605
Echinococcus granulosus Nuclear hormone receptor HR96 0.001 0.0203 0.0166
Loa Loa (eye worm) Smad1 0.0008 0.0154 0.014
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.002 0.0608 0.0572
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.002 0.0608 0.0595
Brugia malayi CXXC zinc finger family protein 0.0029 0.0928 0.0915
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0043 0.1454 0.4898
Echinococcus granulosus tar DNA binding protein 0.027 1 1
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0013 0.0347 0.1659
Brugia malayi ecdysteroid receptor 0.002 0.0608 0.0595
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0083 0.2969 1
Brugia malayi PHD-finger family protein 0.0005 0.0038 0.0024
Brugia malayi MH2 domain containing protein 0.0121 0.4416 0.4408
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0013 0.0347 0.1659
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.002 0.0608 0.5902
Loa Loa (eye worm) endonuclease/Exonuclease/phosphatase 0.0008 0.0147 0.0133
Trichomonas vaginalis ap endonuclease, putative 0.004 0.1353 0.926
Brugia malayi Nuclear hormone receptor family member nhr-25 0.002 0.0608 0.0595
Schistosoma mansoni thyroid hormone receptor 0.002 0.0608 0.0572
Brugia malayi RNA recognition motif domain containing protein 0.027 1 1
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0098 0.3538 1
Brugia malayi hypothetical protein 0.0011 0.0247 0.0233
Onchocerca volvulus 0.002 0.0608 0.5902
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.002 0.0608 0.0572
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.004 0.1353 1
Brugia malayi hypothetical protein 0.0039 0.1319 0.1306
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0039 0.1319 0.1285
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.001 0.0203 0.0166
Loa Loa (eye worm) hypothetical protein 0.001 0.0203 0.0189
Brugia malayi nuclear hormone receptor family member odr-7 0.001 0.0203 0.0189
Trichomonas vaginalis rotamase, putative 0.0034 0.1129 0.762
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.004 0.1353 0.4558
Brugia malayi hypothetical protein 0.0011 0.0247 0.0233
Toxoplasma gondii histone lysine methyltransferase SET1 0.0058 0.2035 0.6689
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.004 0.1353 0.4094
Schistosoma mansoni nuclear hormone receptor 0.001 0.0203 0.0166
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0096 0.345 0.3441
Loa Loa (eye worm) endonuclease/Exonuclease/phosphatase 0.0008 0.0147 0.0133
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0039 0.1319 0.1285
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase 0.0033 0.1099 0.7891
Echinococcus granulosus expressed protein 0.0034 0.1129 0.1095
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0096 0.345 0.3425
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0096 0.345 0.3425
Loa Loa (eye worm) MH1 domain-containing protein 0.0008 0.0154 0.014
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0013 0.0347 0.031
Entamoeba histolytica hypothetical protein 0.0039 0.1319 0.9714
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0013 0.0347 0.031
Loa Loa (eye worm) hypothetical protein 0.001 0.0203 0.0189
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.004 0.1353 0.4274
Echinococcus multilocularis mothers against decapentaplegic 5 0.0008 0.0154 0.0116
Brugia malayi conserved hypotetical protein 0.001 0.0203 0.0189
Brugia malayi MH1 domain containing protein 0.0008 0.0154 0.014
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.004 0.1353 1
Brugia malayi CCR4 0.0008 0.0147 0.0133
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.002 0.0608 0.0595
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0043 0.1454 1
Loa Loa (eye worm) hypothetical protein 0.002 0.0608 0.0595
Leishmania major peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative 0.0033 0.1099 0.7891
Schistosoma mansoni tar DNA-binding protein 0.027 1 1
Loa Loa (eye worm) steroid hormone receptor 0.002 0.0608 0.0595
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0203 0.0166
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.002 0.0608 0.0572
Loa Loa (eye worm) hypothetical protein 0.002 0.0608 0.0595
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.002 0.0608 0.0595
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.001 0.0203 0.0166
Loa Loa (eye worm) hypothetical protein 0.002 0.0608 0.0595
Loa Loa (eye worm) hypothetical protein 0.0008 0.0147 0.0133
Echinococcus multilocularis thioredoxin glutathione reductase 0.0039 0.1319 0.1286
Loa Loa (eye worm) hypothetical protein 0.002 0.0608 0.0595
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0096 0.345 0.3425
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.001 0.0203 0.0721
Loa Loa (eye worm) hypothetical protein 0.0011 0.0247 0.0233
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0013 0.0347 0.0709
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.002 0.0608 0.0572
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0098 0.3538 1
Brugia malayi nuclear receptor RXR 0.0011 0.0247 0.0233
Echinococcus multilocularis thyroid hormone receptor alpha 0.002 0.0608 0.0572
Schistosoma mansoni cript-related 0.0008 0.0147 0.0109
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, putative 0.0033 0.1099 0.7891
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.0054 0.1892 0.5144
Brugia malayi MH2 domain containing protein 0.0008 0.0154 0.014
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.001 0.0213 0.0199
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0043 0.1454 0.4633
Brugia malayi MH1 domain containing protein 0.0008 0.0154 0.014
Plasmodium falciparum thioredoxin reductase 0.0039 0.13 0.4085
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0013 0.0347 0.031
Brugia malayi nuclear receptor RXR 0.001 0.0203 0.0189
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.002 0.0608 0.0595
Brugia malayi Nuclear hormone receptor family member nhr-31 0.002 0.0608 0.0595
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0013 0.0347 0.1659
Echinococcus multilocularis traf and tnf receptor associated protein 0.0008 0.0147 0.0109
Brugia malayi ecdysone receptor 0.001 0.0203 0.0189
Entamoeba histolytica hypothetical protein 0.0039 0.1319 0.9714
Leishmania major trypanothione reductase 0.0039 0.13 0.9557
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0096 0.345 0.3425
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase 0.0033 0.1099 0.7891
Loa Loa (eye worm) hypothetical protein 0.001 0.0203 0.0189
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0008 0.0147 0.0133
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0008 0.0147 0.0133
Loa Loa (eye worm) acetyltransferase 0.0146 0.5325 0.5318
Schistosoma mansoni nuclear hormone receptor 0.002 0.0608 0.0572
Schistosoma mansoni tar DNA-binding protein 0.027 1 1
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0039 0.13 0.3399
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0013 0.0347 0.1659
Brugia malayi Steroid receptor seven-up type 2 0.002 0.0608 0.0595
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0013 0.0347 0.1659
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.001 0.0213 0.0199
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0008 0.0147 0.0133
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0008 0.0147 0.0133
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0146 0.5325 0.5307
Echinococcus granulosus nuclear receptor nhr 48 0.001 0.0203 0.0166
Leishmania major acetoin dehydrogenase e3 component-like protein 0.0013 0.0347 0.1659
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.002 0.0608 0.0572
Entamoeba histolytica hypothetical protein 0.0039 0.1319 0.9714
Brugia malayi hypothetical protein 0.001 0.0203 0.0189
Trichomonas vaginalis rotamase, putative 0.0033 0.1099 0.7398
Loa Loa (eye worm) hypothetical protein 0.001 0.0203 0.0189
Echinococcus granulosus cpg binding protein 0.003 0.099 0.0956
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.0013 0.0347 0.1659
Loa Loa (eye worm) hypothetical protein 0.001 0.0203 0.0189

Activities

Activity type Activity value Assay description Source Reference
Inhibition (functional) = 92 % Inhibition of Escherichia coli ATCC 35695 biofilm formation after 24 hrs by crystal violet reporter assay ChEMBL. 21737267
MIC (functional) = 16 ug ml-1 Antimicrobial activity against Escherichia coli ATCC 35695 after 16 hrs by broth microdilution method ChEMBL. 21737267

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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