Detailed information for compound 987338

Basic information

Technical information
  • TDR Targets ID: 987338
  • Name: 14-[(2S,5R,6R)-5-hydroxy-6-(hydroxymethyl)pip eridin-2-yl]tetradecan-2-one
  • MW: 341.529 | Formula: C20H39NO3
  • H donors: 3 H acceptors: 3 LogP: 4.73 Rotable bonds: 14
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC[C@H]1N[C@@H](CCCCCCCCCCCCC(=O)C)CC[C@H]1O
  • InChi: 1S/C20H39NO3/c1-17(23)12-10-8-6-4-2-3-5-7-9-11-13-18-14-15-20(24)19(16-22)21-18/h18-22,24H,2-16H2,1H3/t18-,19+,20+/m0/s1
  • InChiKey: DIMNETMAIUHJFR-XUVXKRRUSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 14-[(2S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-2-piperidyl]tetradecan-2-one
  • 14-[(2S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-2-piperidinyl]tetradecan-2-one
  • 14-[(2S,5R,6R)-5-hydroxy-6-methylol-2-piperidyl]tetradecan-2-one

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 multidrug Resistance Protein family member (mrp-5), putative 0.0023 0.0047 0.0117
Trichomonas vaginalis conserved hypothetical protein 0.0041 0.0266 0.2656
Entamoeba histolytica ATP-binding cassette protein, putative 0.0023 0.0047 0.0009
Plasmodium vivax ABC transporter B family member 6, putative 0.0023 0.0047 0.003
Plasmodium falciparum diacylglycerol O-acyltransferase 0.0041 0.0266 0.2598
Echinococcus granulosus lysophospholipid acyltransferase 7 0.0041 0.0266 0.0484
Brugia malayi Eukaryotic aspartyl protease family protein 0.0023 0.0045 0.011
Loa Loa (eye worm) hypothetical protein 0.0047 0.0334 0.0702
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0023 0.0047 0.003
Loa Loa (eye worm) hypothetical protein 0.0424 0.4754 1
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0073 0.0633 0.692
Entamoeba histolytica hypothetical protein 0.0047 0.0334 0.0297
Treponema pallidum alginate O-acetylation protein (algI) 0.0041 0.0266 0.5
Echinococcus multilocularis multidrug resistance protein 1 0.0051 0.0375 0.0698
Loa Loa (eye worm) hypothetical protein 0.0047 0.0334 0.0702
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0073 0.0633 0.1244
Leishmania major glycerol uptake protein, putative 0.0041 0.0266 0.044
Toxoplasma gondii LsmAD domain-containing protein 0.0025 0.0076 0.0364
Brugia malayi Phosphatidylcholine:ceramide cholinephosphotransferase 3 0.0047 0.0334 0.0828
Plasmodium vivax multidrug resistance-associated protein 1, putative 0.0023 0.0047 0.003
Brugia malayi Phosphatidylcholine:ceramide cholinephosphotransferase 2 0.0047 0.0334 0.0828
Mycobacterium ulcerans component linked with the assembly of cytochrome transport transmembrane ATP-binding protein ABC transporter CydD 0.0023 0.0047 0.5
Plasmodium vivax sphingomyelin synthase 1, putative 0.0047 0.0334 0.3391
Loa Loa (eye worm) hypothetical protein 0.0095 0.0898 0.1888
Brugia malayi hypothetical protein 0.0023 0.0047 0.0117
Loa Loa (eye worm) MH2 domain-containing protein 0.0362 0.4034 0.8486
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0073 0.0633 0.692
Brugia malayi ABC transporter 0.0022 0.0038 0.0094
Brugia malayi latrophilin 2 splice variant baaae 0.0103 0.0995 0.2466
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0041 0.0266 0.0484
Entamoeba histolytica hypothetical protein 0.0041 0.0266 0.0229
Loa Loa (eye worm) hypothetical protein 0.0151 0.1557 0.3274
Toxoplasma gondii hypothetical protein 0.0041 0.0266 0.2598
Brugia malayi LBP / BPI / CETP family, C-terminal domain containing protein 0.0033 0.0163 0.0405
Brugia malayi Pepsin A precursor 0.0023 0.0045 0.011
Brugia malayi ABC transporter transmembrane region family protein 0.0022 0.0038 0.0094
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0041 0.0266 0.0229
Leishmania major glycerol uptake protein, putative 0.0041 0.0266 0.044
Brugia malayi MH2 domain containing protein 0.0362 0.4034 1
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0073 0.0633 0.692
Plasmodium falciparum multidrug resistance protein 2 0.0023 0.0047 0.003
Loa Loa (eye worm) ATP-binding cassette sub-family B member 2 0.0073 0.0633 0.1331
Brugia malayi aspartic protease BmAsp-2, identical 0.0023 0.0045 0.011
Trichomonas vaginalis ABC transporter, putative 0.0073 0.0633 0.692
Trichomonas vaginalis conserved hypothetical protein 0.0041 0.0266 0.2656
Loa Loa (eye worm) hypothetical protein 0.0047 0.0334 0.0702
Brugia malayi MBOAT family protein 0.0041 0.0266 0.066
Onchocerca volvulus 0.0041 0.0266 0.4207
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0076 0.0057
Trypanosoma cruzi sphingomyelin/ceramide phosphorylethanolamine synthase, bifunctional 0.0447 0.5025 1
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0023 0.0045 0.0014
Entamoeba histolytica P-glycoprotein-2 0.0073 0.0633 0.0597
Echinococcus multilocularis ATP binding cassette sub family B 0.0072 0.0623 0.1225
Plasmodium vivax diacylglycerol O-acyltransferase, putative 0.0041 0.0266 0.2598
Brugia malayi MBOAT family protein 0.0041 0.0266 0.066
Brugia malayi LBP / BPI / CETP family, N-terminal domain containing protein 0.0033 0.0163 0.0405
Entamoeba histolytica vacuolar protein sorting 26 0.0041 0.0266 0.0229
Plasmodium falciparum plasmepsin VI 0.0095 0.0898 1
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0023 0.0045 0.0014
Echinococcus multilocularis GPCR, family 2 0.0048 0.0342 0.0627
Trypanosoma brucei glycerol uptake protein, putative 0.0041 0.0266 0.044
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0023 0.0047 0.003
Leishmania major glycerol uptake protein, putative 0.0041 0.0266 0.044
Trichomonas vaginalis Clan AA, family A1, cathepsin D-like aspartic peptidase 0.0095 0.0898 1
Brugia malayi Phosphatidylcholine:ceramide cholinephosphotransferase 1 0.0047 0.0334 0.0828
Trichomonas vaginalis porcupine, putative 0.0041 0.0266 0.2656
Schistosoma mansoni memapsin-2 (A01 family) 0.0023 0.0045 0.0014
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0041 0.0266 0.0466
Brugia malayi multidrug resistance protein 3 0.0073 0.0633 0.1569
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0023 0.0047 0.5
Mycobacterium leprae PROBABLE DRUGS-TRANSPORT TRANSMEMBRANE ATP-BINDING PROTEIN ABC TRANSPORTER 0.0023 0.0047 0.5
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0073 0.0633 0.1262
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0073 0.0633 0.692
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0051 0.0375 0.3927
Entamoeba histolytica P-glycoprotein-2, putative 0.0073 0.0633 0.0597
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0073 0.0633 0.1244
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0023 0.0045 0.0014
Echinococcus multilocularis Smad4 0.0025 0.007 0.0049
Brugia malayi Hhat protein 0.0041 0.0266 0.066
Entamoeba histolytica P-glycoprotein 5, putative 0.0073 0.0633 0.0597
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0041 0.0266 0.0229
Echinococcus multilocularis membrane bound acyltransferase:hhat 0.0041 0.0266 0.0466
Entamoeba histolytica P-glycoprotein 6, putative 0.0023 0.0047 0.0009
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0073 0.0633 0.1244
Loa Loa (eye worm) hypothetical protein 0.0022 0.0038 0.008
Entamoeba histolytica hypothetical membrane-spanning protein 0.0047 0.0334 0.0297
Onchocerca volvulus 0.0033 0.0163 0.2583
Echinococcus granulosus TGF beta signal transducer SmadC 0.0025 0.007 0.0069
Trypanosoma cruzi glycerol uptake protein, putative 0.0041 0.0266 0.044
Plasmodium vivax ABC transporter B family member 5, putative 0.0023 0.0047 0.003
Toxoplasma gondii acyl-CoA:cholesterol acyltransferase alpha ACAT1-alpha 0.0041 0.0266 0.2598
Schistosoma mansoni cathepsin D (A01 family) 0.0281 0.3074 0.6439
Plasmodium falciparum ABC transporter B family member 5, putative 0.0023 0.0047 0.003
Loa Loa (eye worm) ABC transporter transmembrane region family protein 0.0023 0.0047 0.0099
Entamoeba histolytica P-glycoprotein-1 0.0073 0.0633 0.0597
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0023 0.0045 0.0014
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0025 0.007 0.0069
Loa Loa (eye worm) hypothetical protein 0.0047 0.0334 0.0702
Brugia malayi MH2 domain containing protein 0.0025 0.007 0.0174
Entamoeba histolytica ABC transporter, putative 0.0023 0.0047 0.0009
Onchocerca volvulus 0.0073 0.0633 1
Brugia malayi ABC transporter family protein 0.0023 0.0047 0.0117
Entamoeba histolytica multidrug resistance protein, putative 0.0023 0.0047 0.0009
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0048 0.0342 0.0646
Schistosoma mansoni multidrug resistance protein 0.0073 0.0633 0.1262
Echinococcus multilocularis cathepsin d (lysosomal aspartyl protease) 0.0095 0.0898 0.1807
Brugia malayi P-glycoprotein-like protein 0.0023 0.0047 0.0117
Trypanosoma cruzi GUP1, putative 0.0041 0.0266 0.044
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0023 0.0047 0.003
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0076 0.0364
Plasmodium vivax ataxin-2 like protein, putative 0.0025 0.0076 0.0364
Schistosoma mansoni diacylglycerol O-acyltransferase 1 0.0041 0.0266 0.0484
Brugia malayi ABC transporter transmembrane region family protein 0.0023 0.0047 0.0117
Echinococcus granulosus sterol O acyltransferase 1 0.0424 0.4754 1
Brugia malayi MBOAT family protein 0.0041 0.0266 0.066
Plasmodium falciparum ABC transporter B family member 6, putative 0.0023 0.0047 0.003
Trypanosoma brucei sphingomyelin/ceramide phosphorylethanolamine synthase, bifunctional 0.0447 0.5025 1
Trichomonas vaginalis ABC transporter, half transporter, putative 0.0073 0.0633 0.692
Trypanosoma brucei inositol phosphorylceramide synthase 0.0047 0.0334 0.0576
Schistosoma mansoni hypothetical protein 0.0048 0.0342 0.0646
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0073 0.0633 0.692
Onchocerca volvulus 0.0033 0.0163 0.2583
Brugia malayi hypothetical protein 0.0023 0.0045 0.011
Loa Loa (eye worm) hypothetical protein 0.0073 0.0633 0.1331
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0073 0.0633 0.1262
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0041 0.0266 0.0466
Echinococcus multilocularis multidrug resistance protein 1 0.0073 0.0633 0.1244
Trypanosoma cruzi glycerol uptake protein, putative 0.0041 0.0266 0.044
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0023 0.0045 0.0014
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0073 0.0633 0.6896
Echinococcus granulosus o acyltransferase membrane bound domain 0.0041 0.0266 0.0484
Brugia malayi ABC transporter family protein 0.0023 0.0047 0.0117
Loa Loa (eye worm) MBOAT family protein 0.0041 0.0266 0.056
Loa Loa (eye worm) diacylglycerol acyltransferase 0.0041 0.0266 0.056
Loa Loa (eye worm) hhat protein 0.0041 0.0266 0.056
Loa Loa (eye worm) transcription factor SMAD2 0.0362 0.4034 0.8486
Brugia malayi MBOAT family protein 0.0041 0.0266 0.066
Loa Loa (eye worm) hypothetical protein 0.0025 0.0076 0.0159
Schistosoma mansoni cathepsin D (A01 family) 0.0281 0.3074 0.6439
Loa Loa (eye worm) aspartyl protease 6 0.0023 0.0045 0.0094
Loa Loa (eye worm) hypothetical protein 0.0041 0.0266 0.056
Echinococcus granulosus Membrane bound O acyl transferase MBOAT 0.0041 0.0266 0.0484
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0073 0.0633 0.692
Brugia malayi MBOAT family protein 0.0041 0.0266 0.066
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0073 0.0633 0.692
Toxoplasma gondii aspartyl proteinase (eimepsin), putative 0.0095 0.0898 1
Onchocerca volvulus 0.0023 0.0045 0.0704
Echinococcus granulosus ATP binding cassette sub family B 0.0023 0.0047 0.002
Plasmodium vivax sphingomyelin synthase 2, putative 0.0047 0.0334 0.3391
Echinococcus granulosus diacylglycerol O acyltransferase 1 0.0041 0.0266 0.0484
Schistosoma mansoni multidrug resistance protein 0.0023 0.0047 0.002
Echinococcus granulosus multidrug resistance protein 1 0.0051 0.0375 0.0716
Trichomonas vaginalis sphingomyelin synthetase, putative 0.0047 0.0334 0.3443
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0073 0.0633 0.1244
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0025 0.007 0.0049
Trichomonas vaginalis taga, putative 0.0073 0.0633 0.692
Loa Loa (eye worm) hypothetical protein 0.0022 0.0038 0.008
Giardia lamblia ABC transporter, putative 0.0023 0.0047 1
Brugia malayi Latrophilin receptor protein 2 0.0048 0.0342 0.0849
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0023 0.0047 0.003
Schistosoma mansoni smad 0.0025 0.007 0.0069
Mycobacterium tuberculosis Probable transmembrane multidrug efflux pump 0.0073 0.0633 1
Loa Loa (eye worm) hypothetical protein 0.0041 0.0266 0.056
Echinococcus multilocularis mothers against decapentaplegic 5 0.0025 0.007 0.0049
Schistosoma mansoni hypothetical protein 0.0041 0.0266 0.0484
Leishmania major phosphatidylcholine:ceramide cholinephosphotransferase 2 0.0447 0.5025 1
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0048 0.0342 0.0646
Echinococcus granulosus 5'partial|ATP binding cassette sub family B 0.0072 0.0623 0.1242
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0073 0.0633 0.692
Entamoeba histolytica hypothetical protein 0.0047 0.0334 0.0297
Trichomonas vaginalis sphingomyelin synthetase, putative 0.0047 0.0334 0.3443
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0048 0.0342 0.0627
Brugia malayi diacylglycerol acyltransferase 0.0041 0.0266 0.066
Loa Loa (eye worm) latrophilin receptor protein 2 0.0048 0.0342 0.072
Loa Loa (eye worm) hypothetical protein 0.0103 0.0995 0.2092
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0048 0.0342 0.0849
Giardia lamblia Multidrug resistance-associated protein 1 0.0023 0.0047 1
Schistosoma mansoni smad1 5 8 and 0.0025 0.007 0.0069
Echinococcus granulosus multidrug resistance protein 1 0.0073 0.0633 0.1262
Echinococcus multilocularis lysophospholipid acyltransferase 7 0.0041 0.0266 0.0466
Entamoeba histolytica ATP-binding cassette protein, putative 0.0023 0.0047 0.0009
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0073 0.0633 0.1262
Entamoeba histolytica P-glycoprotein 6, putative 0.0023 0.0047 0.0009
Onchocerca volvulus 0.0033 0.0163 0.2583
Mycobacterium leprae PROBABLE DRUGS-TRANSPORT TRANSMEMBRANE ATP-BINDING PROTEIN ABC TRANSPORTER 0.0023 0.0047 0.5
Plasmodium falciparum ABC transporter B family member 3, putative 0.0023 0.0047 0.003
Echinococcus granulosus membrane bound acyltransferase:hhat 0.0041 0.0266 0.0484
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0023 0.0045 0.0014
Plasmodium falciparum ABC transporter B family member 4, putative 0.0023 0.0047 0.003
Mycobacterium ulcerans drugs-transport transmembrane ATP-binding protein ABC transporter 0.0023 0.0047 0.5
Loa Loa (eye worm) LBP/BPI/CETP family domain-containing protein 0.0033 0.0163 0.0344
Loa Loa (eye worm) hypothetical protein 0.0047 0.0334 0.0702
Toxoplasma gondii ABC transporter family protein 0.0023 0.0047 0.003
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0023 0.0047 0.5
Brugia malayi Phosphatidylcholine:ceramide cholinephosphotransferase 2 0.0047 0.0334 0.0828
Leishmania major ATP-binding cassette protein subfamily B, member 2, putative 0.0073 0.0633 0.1177
Chlamydia trachomatis ABC transporter ATP binding protein/permease 0.0073 0.0633 0.5
Brugia malayi Smad1 0.0025 0.007 0.0174
Loa Loa (eye worm) hypothetical protein 0.0047 0.0334 0.0702
Loa Loa (eye worm) hypothetical protein 0.0382 0.4268 0.8978
Entamoeba histolytica ATP-binding cassette protein, putative 0.0023 0.0047 0.0009
Schistosoma mansoni sterol O-acyltransferase 1 0.0424 0.4754 1
Trichomonas vaginalis sphingomyelin synthetase, putative 0.0047 0.0334 0.3443
Plasmodium falciparum sphingomyelin synthase 2, putative 0.0047 0.0334 0.3391
Echinococcus granulosus mothers against decapentaplegic 5 0.0025 0.007 0.0069
Schistosoma mansoni ATP-binding cassette sub-family B member 7 mitochondrial precursor (abc7) 0.0023 0.0047 0.002
Loa Loa (eye worm) Smad1 0.0025 0.007 0.0148
Entamoeba histolytica hypothetical protein 0.0047 0.0334 0.0297
Brugia malayi multidrug resistance related protein 1 0.0023 0.0047 0.0117
Trichomonas vaginalis abcb9, putative 0.0073 0.0633 0.692
Onchocerca volvulus 0.0033 0.0163 0.2583
Loa Loa (eye worm) ABC transporter 0.0023 0.0047 0.0099
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0076 0.0057
Schistosoma mansoni Smad4 0.0025 0.007 0.0069
Entamoeba histolytica P-glycoprotein-2 0.0073 0.0633 0.0597
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0073 0.0633 0.1262
Echinococcus granulosus multidrug resistance associated protein 7 0.0023 0.0047 0.002
Entamoeba histolytica P-glycoprotein-5 0.0073 0.0633 0.0597
Plasmodium vivax ABC transporter B family member 4, putative 0.0023 0.0047 0.003
Loa Loa (eye worm) MBOAT family protein 0.0041 0.0266 0.056
Echinococcus multilocularis multidrug resistance protein 1 0.0073 0.0633 0.1244
Schistosoma mansoni smdr2 0.0073 0.0633 0.1262
Schistosoma mansoni hypothetical protein 0.0048 0.0342 0.0646
Plasmodium falciparum plasmepsin I 0.0095 0.0898 1
Trypanosoma brucei PAB1-binding protein , putative 0.0025 0.0076 0.0057
Leishmania major glycerol uptake protein, putative 0.0041 0.0266 0.044
Plasmodium falciparum sphingomyelin synthase 1, putative 0.0047 0.0334 0.3391
Schistosoma mansoni smdr1 0.0023 0.0047 0.002
Echinococcus granulosus multidrug resistance protein 1 0.0051 0.0375 0.0716
Schistosoma mansoni membrane-bound acyltransferase/hhat 0.0041 0.0266 0.0484
Echinococcus granulosus o acyltransferase membrane bound domain 0.0041 0.0266 0.0484
Trichomonas vaginalis ABC transporter, putative 0.0073 0.0633 0.692
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0073 0.0633 0.692
Schistosoma mansoni multidrug resistance protein 0.0023 0.0047 0.002
Schistosoma mansoni hypothetical protein 0.0048 0.0342 0.0646
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0073 0.0633 0.692
Trypanosoma cruzi GUP1, putative 0.0041 0.0266 0.044
Wolbachia endosymbiont of Brugia malayi ABC-type multidrug transport system, ATPase and permease component 0.0023 0.0047 0.5
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0073 0.0633 0.692
Schistosoma mansoni multidrug resistance protein 0.0023 0.0047 0.002
Schistosoma mansoni spingomyelin synthetase-related 0.0047 0.0334 0.0628
Entamoeba histolytica hypothetical protein 0.0023 0.0047 0.0009
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0073 0.0633 0.692
Onchocerca volvulus 0.0033 0.0163 0.2583
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0023 0.0047 0.5
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0073 0.0633 0.692
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0073 0.0633 0.1244
Entamoeba histolytica P-glyco protein 6, putative 0.0073 0.0633 0.0597
Schistosoma mansoni smad1 5 8 and 0.0025 0.007 0.0069
Plasmodium vivax ABC transporter B family member 3, putative 0.0023 0.0047 0.003
Giardia lamblia MRP-like ABC transporter 0.0023 0.0047 1
Plasmodium falciparum multidrug resistance-associated protein 2 0.0023 0.0047 0.003
Schistosoma mansoni multidrug resistance protein 0.0073 0.0633 0.1262
Schistosoma mansoni hypothetical protein 0.0048 0.0342 0.0646
Toxoplasma gondii aspartyl protease ASP1 0.0095 0.0898 1
Loa Loa (eye worm) membrane bound O-acyltransferase domain containing 1 0.0041 0.0266 0.056
Trichomonas vaginalis sphingomyelin synthetase, putative 0.0047 0.0334 0.3443
Brugia malayi ABC transporter transmembrane region family protein 0.0023 0.0047 0.0117
Brugia malayi MH1 domain containing protein 0.0025 0.007 0.0174
Trichomonas vaginalis abcb9, putative 0.0073 0.0633 0.692
Toxoplasma gondii ATP-binding cassette transporter ABC.B1 0.0073 0.0633 0.6896
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0073 0.0633 0.692
Echinococcus multilocularis sphingomyelin synthase protein 1 0.0047 0.0334 0.0609
Plasmodium falciparum ABC transporter B family member 7, putative 0.0023 0.0047 0.003
Trypanosoma cruzi glycerol uptake protein, putative 0.0041 0.0266 0.044
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0023 0.0047 0.003
Schistosoma mansoni hypothetical protein 0.0103 0.0995 0.2029
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0048 0.0342 0.0627
Brugia malayi LBP / BPI / CETP family, N-terminal domain containing protein 0.0033 0.0163 0.0405
Brugia malayi ABC transporter family protein 0.0023 0.0047 0.0117
Loa Loa (eye worm) hypothetical protein 0.0023 0.0045 0.0094
Echinococcus granulosus multidrug resistance associated protein 1 0.0023 0.0047 0.002
Trypanosoma brucei ceramide phosphorylethanolamine synthase 0.0047 0.0334 0.0576
Echinococcus granulosus ATP binding cassette sub family B 0.0023 0.0047 0.002
Plasmodium vivax aspartyl proteinase, putative 0.0095 0.0898 1
Loa Loa (eye worm) hypothetical protein 0.0023 0.0045 0.0094
Brugia malayi Sphingomyelin synthase-related 1 0.0047 0.0334 0.0828
Trichomonas vaginalis conserved hypothetical protein 0.0047 0.0334 0.3443
Schistosoma mansoni multidrug resistance protein 0.0023 0.0047 0.002
Plasmodium vivax multidrug resistance protein 2, putative 0.0023 0.0047 0.003
Plasmodium vivax ABC transporter B family member 7, putative 0.0023 0.0047 0.003
Echinococcus granulosus smad 0.0025 0.007 0.0069
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0073 0.0633 0.692
Loa Loa (eye worm) aspartic protease BmAsp-2 0.0095 0.0898 0.1888
Plasmodium vivax multidrug resistance-associated protein 2, putative 0.0023 0.0047 0.003
Onchocerca volvulus 0.0033 0.0163 0.2583
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0073 0.0633 0.692
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0151 0.1557 0.3859
Trypanosoma cruzi sphingomyelin/ceramide phosphorylethanolamine synthase, bifunctional 0.0447 0.5025 1
Plasmodium vivax multidrug resistance protein 1, putative 0.0073 0.0633 0.6896
Leishmania major p-glycoprotein 0.0073 0.0633 0.1177
Leishmania major hypothetical protein, conserved 0.0041 0.0266 0.044
Loa Loa (eye worm) multidrug resistance protein 3 0.0073 0.0633 0.1331
Loa Loa (eye worm) MBOAT family protein 0.0041 0.0266 0.056
Loa Loa (eye worm) hhat protein 0.0041 0.0266 0.056
Onchocerca volvulus 0.0033 0.0163 0.2583
Brugia malayi Phosphatidylcholine:ceramide cholinephosphotransferase 1 0.0047 0.0334 0.0828
Loa Loa (eye worm) hypothetical protein 0.0033 0.0163 0.0344
Brugia malayi hypothetical protein 0.0023 0.0045 0.011
Loa Loa (eye worm) ABC transporter 0.0023 0.0047 0.0099
Schistosoma mansoni multidrug resistance protein 0.0073 0.0633 0.1262
Toxoplasma gondii ATP-binding cassette sub-family B member 5 0.0023 0.0047 0.003
Plasmodium falciparum multidrug resistance-associated protein 1 0.0023 0.0047 0.003
Echinococcus multilocularis smad 0.0025 0.007 0.0049
Brugia malayi hypothetical protein 0.0025 0.0076 0.0187
Loa Loa (eye worm) hypothetical protein 0.0048 0.0342 0.072
Schistosoma mansoni smad1 5 8 and 0.0025 0.007 0.0069
Entamoeba histolytica hypothetical protein, conserved 0.0041 0.0266 0.0229
Trichomonas vaginalis ABC transporter, putative 0.0073 0.0633 0.692
Plasmodium falciparum plasmepsin II 0.0095 0.0898 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0623 0.1312
Wolbachia endosymbiont of Brugia malayi ABC-type protease secretion system, ATPase and permease component, AprD 0.0023 0.0047 0.5
Echinococcus granulosus Smad4 0.0025 0.007 0.0069
Echinococcus multilocularis sterol O acyltransferase 1 0.0424 0.4754 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.0151 0.1557 0.3859
Toxoplasma gondii ABC transporter, putative 0.0023 0.0047 0.003
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0023 0.0045 0.0014
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0041 0.0266 0.0466
Echinococcus granulosus cathepsin d lysosomal aspartyl protease 0.0095 0.0898 0.1823
Loa Loa (eye worm) hypothetical protein 0.0041 0.0266 0.056
Loa Loa (eye worm) MH1 domain-containing protein 0.0025 0.007 0.0148
Echinococcus granulosus multidrug resistance protein 1 0.0073 0.0633 0.1262
Brugia malayi ABC transporter family protein 0.0073 0.0633 0.1569
Giardia lamblia Multidrug resistance-associated protein 1 0.0023 0.0047 1
Entamoeba histolytica ATP-binding cassette protein, putative 0.0023 0.0047 0.0009
Trichomonas vaginalis abcb9, putative 0.0073 0.0633 0.692
Toxoplasma gondii acyl-CoA:diacylglycerol acyltransferase 1-related enzyme 0.0041 0.0266 0.2598
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0041 0.0266 0.0484
Loa Loa (eye worm) aspartic protease BmAsp-1 0.0023 0.0045 0.0094
Brugia malayi ABC transporter 0.0023 0.0047 0.0117
Loa Loa (eye worm) hypothetical protein 0.0073 0.0633 0.1331
Echinococcus granulosus o acyltransferase membrane bound domain 0.0041 0.0266 0.0484
Schistosoma mansoni multidrug resistance protein 0.0023 0.0047 0.002
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0073 0.0633 0.692
Echinococcus granulosus multidrug resistance protein 1 0.0073 0.0633 0.1262
Trichomonas vaginalis conserved hypothetical protein 0.0041 0.0266 0.2656
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0095 0.0898 0.1823
Plasmodium vivax plasmepsin IV, putative 0.0095 0.0898 1
Loa Loa (eye worm) hypothetical protein 0.0023 0.0047 0.0099
Trichomonas vaginalis ABC transporter, half transporter, putative 0.0073 0.0633 0.692
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0073 0.0633 0.692
Schistosoma mansoni zinc finger protein 0.0041 0.0266 0.0484
Loa Loa (eye worm) hypothetical protein 0.0023 0.0047 0.0099
Onchocerca volvulus 0.0033 0.0163 0.2583
Trypanosoma brucei glycerol uptake protein, putative 0.0041 0.0266 0.044
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0041 0.0266 0.0229
Toxoplasma gondii hypothetical protein 0.0047 0.0334 0.3391
Trichomonas vaginalis hypothetical protein 0.0047 0.0334 0.3443
Plasmodium falciparum sphingomyelin synthase 1, putative 0.0047 0.0334 0.3391
Echinococcus multilocularis protein cysteine N palmitoyltransferase 0.0041 0.0266 0.0466
Echinococcus granulosus GPCR family 2 0.0048 0.0342 0.0646
Plasmodium falciparum plasmepsin IV 0.0095 0.0898 1
Entamoeba histolytica hypothetical protein 0.0047 0.0334 0.0297
Brugia malayi MH2 domain containing protein 0.0025 0.007 0.0174
Leishmania major glycerol uptake protein, putative 0.0041 0.0266 0.044
Echinococcus granulosus protein cysteine N palmitoyltransferase 0.0041 0.0266 0.0484
Brugia malayi aspartic protease BmAsp-1, identical 0.0023 0.0045 0.011
Brugia malayi MH1 domain containing protein 0.0025 0.007 0.0174
Leishmania major hypothetical protein, conserved 0.0025 0.0076 0.0057
Echinococcus multilocularis Membrane bound O acyl transferase, MBOAT 0.0041 0.0266 0.0466
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0076 0.0364
Echinococcus granulosus sphingomyelin synthase protein 1 0.0047 0.0334 0.0628
Loa Loa (eye worm) ABC transporter 0.0023 0.0047 0.0099
Onchocerca volvulus 0.0023 0.0045 0.0704
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0151 0.1557 0.3274
Entamoeba histolytica hypothetical protein 0.0047 0.0334 0.0297
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0073 0.0633 0.692
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0073 0.0633 0.692
Loa Loa (eye worm) hypothetical protein 0.0023 0.0047 0.0099
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0023 0.0047 0.003
Loa Loa (eye worm) MH2 domain-containing protein 0.0025 0.007 0.0148
Trichomonas vaginalis transmembrane protein nessy, putative 0.0041 0.0266 0.2656
Schistosoma mansoni leukocyte receptor cluster (lrc) member 4 protein 0.0041 0.0266 0.0484
Plasmodium falciparum multidrug resistance protein 1 0.0073 0.0633 0.6896
Echinococcus multilocularis diacylglycerol O acyltransferase 1 0.0041 0.0266 0.0466
Trichomonas vaginalis ABC transporter, putative 0.0073 0.0633 0.692
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0023 0.0045 0.0014
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0041 0.0266 0.0484
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0023 0.0047 0.0108
Trypanosoma brucei sphingomyelin/ceramide phosphorylethanolamine synthase, bifunctional 0.0447 0.5025 1

Activities

Activity type Activity value Assay description Source Reference
Activity (functional) DNA damaging activity against RS 321N Saccharomyces cerevisiae ChEMBL. 15165164
Activity (functional) DNA damaging activity against DNA RS 322YK (RAD 332Y) Saccharomyces cerevisiae ChEMBL. 15165164
Activity (functional) DNA damaging activity against RS 188N (RAD+) Saccharomyces cerevisiae ChEMBL. 15165164

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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