Detailed information for compound 409781

Basic information

Technical information
  • TDR Targets ID: 409781
  • Name: cyclopentyl N-[(2S,3S)-1,4-diphenyl-3-[4-[[4- [4-(trifluoromethyl)phenyl]piperazin-1-yl]met hyl]triazol-1-yl]butan-2-yl]carbamate
  • MW: 646.745 | Formula: C36H41F3N6O2
  • H donors: 1 H acceptors: 3 LogP: 6.97 Rotable bonds: 14
    Rule of 5 violations (Lipinski): 2
  • SMILES: O=C(N[C@H]([C@@H](n1nnc(c1)CN1CCN(CC1)c1ccc(cc1)C(F)(F)F)Cc1ccccc1)Cc1ccccc1)OC1CCCC1
  • InChi: 1S/C36H41F3N6O2/c37-36(38,39)29-15-17-31(18-16-29)44-21-19-43(20-22-44)25-30-26-45(42-41-30)34(24-28-11-5-2-6-12-28)33(23-27-9-3-1-4-10-27)40-35(46)47-32-13-7-8-14-32/h1-6,9-12,15-18,26,32-34H,7-8,13-14,19-25H2,(H,40,46)/t33-,34-/m0/s1
  • InChiKey: FQLDYRIDUMTKQK-HEVIKAOCSA-N  

Network

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Synonyms

  • cyclopentyl N-[(1S,2S)-1-benzyl-3-phenyl-2-[4-[[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]triazol-1-yl]propyl]carbamate
  • N-[(1S,2S)-1-benzyl-3-phenyl-2-[4-[[4-[4-(trifluoromethyl)phenyl]-1-piperazinyl]methyl]-1-triazolyl]propyl]carbamic acid cyclopentyl ester
  • cyclopentyl N-[(2S,3S)-1,4-diphenyl-3-[4-[[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]-1,2,3-triazol-1-yl]butan-2-yl]carbamate
  • N-[(1S,2S)-1-benzyl-3-phenyl-2-[4-[[4-[4-(trifluoromethyl)phenyl]piperazino]methyl]triazol-1-yl]propyl]carbamic acid cyclopentyl ester
  • cyclopentyl N-[(2S,3S)-1,4-di(phenyl)-3-[4-[[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]triazol-1-yl]butan-2-yl]carbamate
  • cyclopentyl N-[(1S,2S)-3-phenyl-1-(phenylmethyl)-2-[4-[[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]triazol-1-yl]propyl]carbamate
  • N-[(1S,2S)-3-phenyl-1-(phenylmethyl)-2-[4-[[4-[4-(trifluoromethyl)phenyl]-1-piperazinyl]methyl]-1-triazolyl]propyl]carbamic acid cyclopentyl ester
  • N-[(1S,2S)-1-(benzyl)-3-phenyl-2-[4-[[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]triazol-1-yl]propyl]carbamic acid cyclopentyl ester
  • cyclopentyl N-[(2S,3S)-1,4-di(phenyl)-3-[4-[[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]-1,2,3-triazol-1-yl]butan-2-yl]carbamate
  • AIDS-470562
  • AIDS470562
  • N-((1S,2S)-3-Phenyl-1-benzyl-2-{4-[(4-(4-trifluoromethylphenyl)piperazinyl)methyl](1,2,3-triazolyl)}propyl)cyclopentyloxycarboxamide

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
Leishmania major calcium-transporting ATPase, putative 0.0048 0.02 0.4213
Trypanosoma brucei vacuolar-type Ca2+-ATPase, putative 0.005 0.021 0.4509
Giardia lamblia Myb 1-like protein 0.0057 0.0247 1
Brugia malayi Cadherin domain containing protein 0.0026 0.0081 0.1772
Loa Loa (eye worm) hypothetical protein 0.0081 0.0375 0.6533
Toxoplasma gondii P-type ATPase PMA1 0.0025 0.0077 0.0275
Loa Loa (eye worm) hypothetical protein 0.0026 0.0081 0.1405
Loa Loa (eye worm) hypothetical protein 0.0081 0.0375 0.6533
Trichomonas vaginalis conserved hypothetical protein 0.0038 0.0145 0.3122
Trichomonas vaginalis C-MYB, putative 0.0057 0.0246 0.5281
Loa Loa (eye worm) hypothetical protein 0.0026 0.0081 0.1405
Brugia malayi calcium ATPase 0.003 0.01 0.2192
Toxoplasma gondii LsmAD domain-containing protein 0.0025 0.0073 0.0261
Trypanosoma brucei calcium-translocating P-type ATPase 0.0096 0.0456 1
Entamoeba histolytica phospholipid-transporting P-type ATPase, putative 0.0015 0.0019 0.0758
Loa Loa (eye worm) hypothetical protein 0.0026 0.0081 0.1405
Brugia malayi Cadherin domain containing protein 0.0026 0.0081 0.1772
Trypanosoma cruzi calcium motive p-type ATPase, putative 0.0048 0.02 0.4213
Loa Loa (eye worm) hypothetical protein 0.0015 0.0019 0.0324
Trypanosoma brucei vacuolar-type Ca2+-ATPase 2 0.005 0.021 0.4509
Trichomonas vaginalis chromobox protein, putative 0.0041 0.0161 0.3457
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.0057 0.0246 0.5281
Trichomonas vaginalis cation-transporting ATPase, putative 0.0015 0.0019 0.04
Entamoeba histolytica plasma membrane calcium ion-transporting ATPase, putative 0.0034 0.0125 0.5062
Echinococcus multilocularis protein jagged 1 0.0026 0.0081 0.0227
Loa Loa (eye worm) CHromoDomain protein family member 0.0011 0.0001 0.00000000037338
Mycobacterium ulcerans 3-phosphoshikimate 1-carboxyvinyltransferase 0.0528 0.2777 0.2763
Chlamydia trachomatis phosphoshikimate 1-carboxyl vinyltransferase 0.0528 0.2777 0.2763
Trichomonas vaginalis ATPase, class I, type 8B, putative 0.0015 0.0019 0.04
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.0057 0.0246 0.5281
Trichomonas vaginalis cation-transporting ATPase, putative 0.0098 0.0465 1
Brugia malayi EGF-like domain containing protein 0.0026 0.0081 0.1772
Loa Loa (eye worm) hypothetical protein 0.0058 0.0254 0.4412
Plasmodium falciparum calcium-transporting ATPase 0.0094 0.0444 0.9249
Echinococcus granulosus copper transporting ATPase 1 0.0015 0.0019 0.0053
Schistosoma mansoni slit 0.0026 0.0081 0.0227
Trypanosoma cruzi plasma-membrane proton-efflux P-type ATPase, putative 0.0019 0.0041 0.0722
Giardia lamblia Plasma membrane calcium-transporting ATPase 2 0.0043 0.0174 0.6781
Entamoeba histolytica hypothetical protein 0.0035 0.0129 0.5254
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.005 0.021 0.4507
Onchocerca volvulus 0.005 0.021 0.5583
Trichomonas vaginalis DNA helicase recq1, putative 0.0023 0.0067 0.1423
Brugia malayi Animal haem peroxidase family protein 0.0081 0.0375 0.8237
Brugia malayi calcium ATPase 0.0019 0.0041 0.0888
Echinococcus granulosus protein jagged 1 0.0026 0.0081 0.0227
Trypanosoma cruzi plasma membrane Ca2+ ATPase 0.005 0.021 0.4417
Echinococcus multilocularis peroxidasin 0.0081 0.0375 0.105
Echinococcus granulosus cation transporting atpase worm 0.0015 0.0019 0.0053
Echinococcus granulosus chromodomain helicase DNA binding protein 1 0.0011 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0015 0.0019 0.0324
Leishmania major vacuolar-type Ca2 -ATPase, putative 0.005 0.021 0.4417
Onchocerca volvulus 0.003 0.0101 0.2688
Loa Loa (eye worm) hypothetical protein 0.0015 0.0019 0.0324
Schistosoma mansoni chromodomain helicase DNA binding protein 0.0011 0.0001 0.0001
Schistosoma mansoni notch 0.0026 0.0081 0.0227
Entamoeba histolytica plasma membrane calcium-transporting ATPase 1, putative 0.0031 0.011 0.4447
Schistosoma mansoni hypothetical protein 0.0026 0.0081 0.0227
Trichomonas vaginalis cation-transporting ATPase, putative 0.005 0.021 0.4507
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.0057 0.0247 0.5313
Toxoplasma gondii Myb family DNA-binding domain-containing protein 0.0057 0.0247 0.0888
Schistosoma mansoni hypothetical protein 0.0026 0.0081 0.0227
Brugia malayi E1-E2 ATPase family protein 0.0015 0.0019 0.0408
Mycobacterium leprae PROBABLE UDP-N-ACETYLGLUCOSAMINE 1-CARBOXYVINYLTRANSFERASE MURA 0.1346 0.7164 1
Echinococcus granulosus microtubule associated protein 2 0.0677 0.3574 1
Loa Loa (eye worm) hypothetical protein 0.0026 0.0081 0.1405
Trypanosoma cruzi calcium-translocating P-type ATPase, putative 0.0019 0.0041 0.0722
Loa Loa (eye worm) hypothetical protein 0.0026 0.0081 0.1405
Leishmania major P-type H -ATPase, putative 0.0025 0.0077 0.151
Schistosoma mansoni hypothetical protein 0.0026 0.0081 0.0227
Onchocerca volvulus Peroxidasin homolog 0.0081 0.0375 1
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.0057 0.0246 0.5281
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0011 0.0001 0.00000000046135
Brugia malayi Probable cation-transporting ATPase C10C6.6 in chromosome IV 0.0015 0.0019 0.0408
Plasmodium vivax hypothetical protein, conserved 0.0011 0.0001 0.00000000044683
Echinococcus granulosus neurogenic locus protein delta 0.0026 0.0081 0.0227
Schistosoma mansoni plasma membrane calcium-transporting atpase 0.0048 0.02 0.0561
Leishmania major P-type H -ATPase, putative 0.0025 0.0077 0.151
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0011 0.0001 0.00000000046135
Loa Loa (eye worm) hypothetical protein 0.0026 0.0081 0.1405
Echinococcus multilocularis plasma membrane calcium transporting ATPase 0.0048 0.02 0.0561
Trypanosoma cruzi copper-transporting ATPase-like protein, putative 0.0015 0.0019 0.0244
Loa Loa (eye worm) notch protein 0.0026 0.0081 0.1405
Onchocerca volvulus Peroxidase homolog 0.0081 0.0375 1
Echinococcus granulosus delta-like protein 1 0.0026 0.0081 0.0227
Schistosoma mansoni ATPase 0.0098 0.0465 0.1301
Brugia malayi Membrane calcium atpase protein 3 0.0048 0.02 0.4394
Plasmodium vivax cation transporting ATPase, putative 0.0015 0.0019 0.0388
Loa Loa (eye worm) hypothetical protein 0.0081 0.0375 0.6533
Echinococcus multilocularis Chromo domain 0.0011 0.0001 0.0001
Echinococcus multilocularis copper transporting ATPase 1 0.0015 0.0019 0.0053
Toxoplasma gondii plasma membrane-type Ca(2+)-ATPase A1 PMCAA1 0.0048 0.02 0.072
Trichomonas vaginalis chromobox protein, putative 0.0068 0.0306 0.6579
Loa Loa (eye worm) hypothetical protein 0.0081 0.0375 0.6533
Echinococcus granulosus geminin 0.0332 0.1721 0.4816
Trichomonas vaginalis pc-MYB2, putative 0.0057 0.0246 0.5281
Echinococcus granulosus peroxidasin 0.0081 0.0375 0.105
Toxoplasma gondii chromodomain helicase DNA binding protein CHD1/SWI2/SNF2 0.0011 0.0001 0.00000000007717
Loa Loa (eye worm) hypothetical protein 0.0026 0.0081 0.1405
Schistosoma mansoni cation-transporting atpase worm 0.0015 0.0019 0.0053
Onchocerca volvulus 0.0026 0.0081 0.2151
Echinococcus multilocularis fat cadherin tumor suppressor 0.0026 0.0081 0.0227
Brugia malayi Animal haem peroxidase family protein 0.0081 0.0375 0.8237
Loa Loa (eye worm) hypothetical protein 0.0098 0.0465 0.8093
Schistosoma mansoni cation-transporting atpase 13a1 (G-box binding protein) 0.0015 0.0019 0.0053
Echinococcus granulosus Chromo domain 0.0011 0.0001 0.0001
Onchocerca volvulus Chorion peroxidase homolog 0.0081 0.0375 1
Echinococcus granulosus sarco:endoplasmic reticulum calcium ATPase 0.0098 0.0465 0.1301
Echinococcus multilocularis neurogenic locus notch protein 0.0026 0.0081 0.0227
Schistosoma mansoni cation-transporting ATPase 0.0015 0.0019 0.0053
Loa Loa (eye worm) hypothetical protein 0.0026 0.0081 0.1405
Entamoeba histolytica hypothetical protein 0.0035 0.0129 0.5254
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0016 0.0025 0.0088
Loa Loa (eye worm) calcium-transporting ATPase sarcoplasmic/endoplasmic reticulum type 0.0085 0.0398 0.6922
Entamoeba histolytica myb-like DNA-binding domain containing protein 0.0057 0.0246 1
Brugia malayi EGF-like domain containing protein 0.0026 0.0081 0.1772
Echinococcus granulosus Ca2 transporting ATPase plasma membrane 0.0048 0.02 0.0561
Onchocerca volvulus Putative cubilin 0.0026 0.0081 0.2151
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0011 0.0001 0.00000000046135
Loa Loa (eye worm) calcium ATPase 0.0034 0.0125 0.2164
Brugia malayi Calcium binding EGF domain containing protein 0.0026 0.0081 0.1772
Trypanosoma cruzi plasma membrane Ca2+ ATPase 0.005 0.021 0.4417
Schistosoma mansoni chromobox protein 0.0011 0.0001 0.0001
Entamoeba histolytica hypothetical protein 0.0035 0.0129 0.5254
Entamoeba histolytica hypothetical protein 0.0011 0.0001 0.00000000087354
Entamoeba histolytica Plasma membrane calcium-transporting ATPase, putative 0.005 0.021 0.8533
Echinococcus multilocularis chromodomain helicase DNA binding protein 1 0.0011 0.0001 0.0001
Toxoplasma gondii calcium-translocating P-type ATPase, PMCA-type protein 0.0052 0.0221 0.0796
Echinococcus multilocularis neural cadherin 0.0026 0.0081 0.0227
Entamoeba histolytica myb-like DNA-binding domain containing protein 0.0057 0.0246 1
Mycobacterium leprae probable 3-phosphoshikimate 1-carboxyvinyl transferase AroA (5-ENOLPYRUVYLSHIKIMATE-3-PHOSPHATE SYNTHASE) (EPSP SYNTHASE) (EPSPS 0.0528 0.2777 0.3859
Brugia malayi GCC2 and GCC3 family protein 0.0026 0.0081 0.1772
Brugia malayi Animal haem peroxidase family protein 0.0081 0.0375 0.8237
Echinococcus multilocularis cation transporting ATPase 13A3 0.0015 0.0019 0.0053
Echinococcus multilocularis chromodomain helicase DNA binding protein 4 0.0011 0.0001 0.0001
Mycobacterium ulcerans UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.1875 1 1
Echinococcus multilocularis phospholipid transporting ATPase IIB 0.0015 0.0019 0.0053
Schistosoma mansoni notch 0.0026 0.0081 0.0227
Echinococcus multilocularis calcium transporting ATPase type 2C member 0.01 0.048 0.1343
Loa Loa (eye worm) hypothetical protein 0.0038 0.0143 0.2476
Echinococcus multilocularis cation transporting ATPase 13A1 0.0015 0.0019 0.0053
Toxoplasma gondii haloacid dehalogenase family hydrolase domain-containing protein 0.0015 0.0019 0.0067
Loa Loa (eye worm) Notch2 0.0026 0.0081 0.1405
Trichomonas vaginalis cation-transporting ATPase fungi, putative 0.005 0.021 0.4507
Trichomonas vaginalis cation-transporting ATPase, putative 0.0098 0.0465 1
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.005 0.021 0.4507
Echinococcus multilocularis neurogenic locus protein delta 0.0026 0.0081 0.0227
Echinococcus granulosus cation transporting ATPase 13A1 0.0015 0.0019 0.0053
Loa Loa (eye worm) animal heme peroxidase 0.0081 0.0375 0.6533
Loa Loa (eye worm) hypothetical protein 0.003 0.0101 0.1756
Schistosoma mansoni Pro-neuregulin-4 membrane-bound isoform (Pro-NRG4) [Contains: Neuregulin-4 (NRG-4)] 0.0026 0.0081 0.0227
Brugia malayi notch-like transmembrane receptor 0.0026 0.0081 0.1772
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0011 0.0001 0.00000000046135
Echinococcus multilocularis protein jagged 1 0.0026 0.0081 0.0227
Loa Loa (eye worm) hypothetical protein 0.0081 0.0375 0.6533
Entamoeba histolytica recQ family helicase, putative 0.0013 0.0008 0.0304
Echinococcus multilocularis calcium transporting atpase 0.0096 0.0456 0.1275
Loa Loa (eye worm) hypothetical protein 0.0081 0.0375 0.6533
Onchocerca volvulus Peroxidase homolog 0.0081 0.0375 1
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.0129 0.0362
Loa Loa (eye worm) hypothetical protein 0.0053 0.0225 0.391
Brugia malayi Probable calcium-transporting ATPase KIAA0703 0.0083 0.0386 0.8473
Entamoeba histolytica plasma membrane calcium ion-transporting ATPase, putative 0.0021 0.0056 0.2263
Echinococcus granulosus neurogenic locus notch protein 4 0.0026 0.0081 0.0227
Onchocerca volvulus Neurogenic locus notch homolog 0.0026 0.0081 0.2151
Brugia malayi Animal haem peroxidase family protein 0.0081 0.0375 0.8237
Leishmania major calcium motive p-type ATPase, putative 0.0048 0.02 0.4213
Trichomonas vaginalis chromobox protein, putative 0.0068 0.0306 0.6579
Plasmodium vivax ataxin-2 like protein, putative 0.0025 0.0073 0.1509
Echinococcus multilocularis chromobox protein 2 0.0011 0.0001 0.0001
Leishmania major vacuolar-type Ca2 -ATPase, putative 0.005 0.021 0.4417
Entamoeba histolytica myb-like DNA-binding domain containing protein 0.0057 0.0246 1
Schistosoma mansoni hypothetical protein 0.0332 0.1721 0.4816
Trichomonas vaginalis conserved hypothetical protein 0.0027 0.0086 0.1835
Loa Loa (eye worm) hypothetical protein 0.0081 0.0375 0.6533
Onchocerca volvulus 0.0026 0.0081 0.2151
Plasmodium falciparum chromodomain-helicase-DNA-binding protein 1 homolog, putative 0.0011 0.0001 0.00000000044683
Loa Loa (eye worm) hypothetical protein 0.0026 0.0081 0.1405
Loa Loa (eye worm) hypothetical protein 0.0026 0.0081 0.1405
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0011 0.0001 0.00000000046135
Toxoplasma gondii P-type ATPase4, putative 0.0053 0.0225 0.0808
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.0129 0.0362
Loa Loa (eye worm) hypothetical protein 0.0025 0.0074 0.1273
Loa Loa (eye worm) RecQ helicase 0.0023 0.0067 0.1152
Loa Loa (eye worm) hypothetical protein 0.0026 0.0081 0.1405
Echinococcus granulosus calcium transporting ATPase type 2C member 0.01 0.048 0.1343
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0041 0.0161 0.4283
Schistosoma mansoni plasma membrane calcium-transporting atpase 0.0048 0.02 0.0561
Trypanosoma brucei calcium motive p-type ATPase, putative 0.0048 0.02 0.4301
Echinococcus multilocularis sarco:endoplasmic reticulum calcium ATPase 0.0098 0.0465 0.1301
Loa Loa (eye worm) hypothetical protein 0.0026 0.0081 0.1405
Schistosoma mansoni hypothetical protein 0.0332 0.1721 0.4816
Schistosoma mansoni chromobox protein 0.0068 0.0306 0.0856
Trichomonas vaginalis phospholipid-transporting ATPase, putative 0.0015 0.0019 0.04
Trypanosoma cruzi calcium-translocating P-type ATPase, putative 0.0072 0.0329 0.7018
Trichomonas vaginalis conserved hypothetical protein 0.0027 0.0086 0.1835
Schistosoma mansoni peroxidasin 0.0081 0.0375 0.105
Echinococcus granulosus notch 0.0026 0.0081 0.0227
Schistosoma mansoni chromobox protein 0.0011 0.0001 0.0001
Echinococcus multilocularis microtubule associated protein 2 0.0677 0.3574 1
Loa Loa (eye worm) sodium/potassium-transporting ATPase subunit alpha 0.0042 0.0167 0.2902
Mycobacterium ulcerans metal cation-transporting p-type ATPase F, CtpF 0.01 0.048 0.0462
Loa Loa (eye worm) hypothetical protein 0.0026 0.0081 0.1405
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.0057 0.0246 0.5281
Schistosoma mansoni hypothetical protein 0.0026 0.0081 0.0227
Echinococcus granulosus Na:K ATPase alpha subunit 0.0046 0.0189 0.0528
Loa Loa (eye worm) hypothetical protein 0.0081 0.0375 0.6533
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.0057 0.0246 0.5281
Trypanosoma cruzi calcium-transporting ATPase, putative 0.0038 0.0143 0.2946
Schistosoma mansoni hypothetical protein 0.0035 0.0129 0.0362
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative 0.0016 0.0026 0.0528
Loa Loa (eye worm) hypothetical protein 0.0026 0.0081 0.1405
Brugia malayi E1-E2 ATPase family protein 0.0028 0.0092 0.2012
Onchocerca volvulus 0.0026 0.0081 0.2151
Mycobacterium tuberculosis Probable metal cation transporter P-type ATPase A CtpF 0.0048 0.0196 0.0247
Entamoeba histolytica Plasma membrane calcium-transporting ATPase, putative 0.005 0.021 0.8533
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0011 0.0001 0.00000000046135
Schistosoma mansoni chromobox protein-related (chromobox 1) (heterochromatin 1) 0.0011 0.0001 0.0001
Trypanosoma brucei copper-transporting ATPase-like protein, putative 0.0015 0.0019 0.0249
Onchocerca volvulus Peroxidasin homolog 0.0081 0.0375 1
Brugia malayi Delta serrate ligand family protein 0.0026 0.0081 0.1772
Brugia malayi hypothetical protein 0.0016 0.0026 0.0561
Schistosoma mansoni peroxidasin 0.0081 0.0375 0.105
Onchocerca volvulus 0.0081 0.0375 1
Plasmodium falciparum copper-transporting ATPase 0.0015 0.0019 0.0388
Wolbachia endosymbiont of Brugia malayi UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.1875 1 0.5
Brugia malayi Calcium binding EGF domain containing protein 0.0026 0.0081 0.1772
Trypanosoma cruzi P-type H+-ATPase, putative 0.0019 0.0041 0.0722
Echinococcus granulosus neurogenic locus notch protein 0.0026 0.0081 0.0227
Leishmania major calcium-translocating P-type ATPase 0.0098 0.0465 1
Loa Loa (eye worm) hypothetical protein 0.0026 0.0081 0.1405
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0038 0.0145 0.3868
Entamoeba histolytica myb-like DNA-binding domain containing protein 0.0057 0.0246 1
Echinococcus granulosus chromodomain helicase DNA binding protein 4 0.0011 0.0001 0.0001
Trichomonas vaginalis DNA helicase recq, putative 0.0013 0.0008 0.0161
Echinococcus multilocularis geminin 0.0332 0.1721 0.4816
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0073 0.1421
Brugia malayi EGF-like domain containing protein 0.0026 0.0081 0.1772
Onchocerca volvulus Slit protein homolog 0.0026 0.0081 0.2151
Schistosoma mansoni calcium-transporting atpase sarcoplasmic/endoplasmic reticulum type (calcium pump) 0.0096 0.0456 0.1275
Echinococcus granulosus slit 2 protein 0.0026 0.0081 0.0227
Trypanosoma brucei P-type H+-ATPase, putative 0.0025 0.0077 0.1541
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0073 0.1421
Trichomonas vaginalis MYB72, putative 0.0057 0.0246 0.5281
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0011 0.0001 0.00000000046135
Treponema pallidum UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.1875 1 1
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0011 0.0001 0.00000000046135
Schistosoma mansoni chromobox protein 0.0068 0.0306 0.0856
Trichomonas vaginalis DNA helicase recq, putative 0.0023 0.0067 0.1423
Entamoeba histolytica chromodomain-helicase-DNA-binding protein, putative 0.0011 0.0001 0.00000000087354
Loa Loa (eye worm) hypothetical protein 0.0081 0.0375 0.6533
Loa Loa (eye worm) hypothetical protein 0.0081 0.0375 0.6533
Brugia malayi haloacid dehalogenase-like hydrolase family protein 0.0034 0.0125 0.2728
Echinococcus multilocularis bloom syndrome protein 0.0023 0.0067 0.0186
Echinococcus multilocularis chromobox protein 1 0.0068 0.0306 0.0856
Entamoeba histolytica myb-like DNA-binding domain containing protein 0.0057 0.0246 1
Trichomonas vaginalis chromobox protein, putative 0.0041 0.0161 0.3457
Echinococcus granulosus calcium transporting atpase 0.0096 0.0456 0.1275
Schistosoma mansoni chromodomain helicase DNA binding protein 0.0011 0.0001 0.0001
Trichomonas vaginalis C-MYB, putative 0.0057 0.0246 0.5281
Echinococcus granulosus chromobox protein 2 0.0011 0.0001 0.0001
Brugia malayi Calcium binding EGF domain containing protein 0.0026 0.0081 0.1772
Brugia malayi Na,K-ATPase alpha subunit 0.0053 0.0225 0.4931
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.005 0.021 0.4507
Onchocerca volvulus 0.0081 0.0375 1
Brugia malayi Transmembrane cell adhesion receptor mua-3 precursor, putative 0.0026 0.0081 0.1772
Trypanosoma cruzi cation-transporting ATPase, putative 0.0015 0.0019 0.0244
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0011 0.0001 0.0001
Echinococcus multilocularis Chromobox protein 3 0.0011 0.0001 0.0001
Brugia malayi Blistered cuticle protein 3 0.0081 0.0375 0.8237
Echinococcus multilocularis Ca2+ transporting ATPase plasma membrane 0.0048 0.02 0.0561
Onchocerca volvulus Dual oxidase homolog 0.0081 0.0375 1
Echinococcus multilocularis Tetracycline resistance leader peptide, TetL 0.0053 0.0225 0.0629
Schistosoma mansoni na+/k+ atpase alpha subunit 0.0046 0.0189 0.0528
Schistosoma mansoni microtubule-associated protein tau 0.0677 0.3574 1
Onchocerca volvulus Neurogenic locus notch protein homolog 0.0026 0.0081 0.2151
Loa Loa (eye worm) Na,K-ATPase alpha subunit 0.0053 0.0225 0.391
Entamoeba histolytica phospholipid-transporting P-type ATPase, putative 0.0017 0.0034 0.1373
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0046 0.0189 0.4056
Echinococcus granulosus fibropellin Ia 0.0026 0.0081 0.0227
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0011 0.0001 0.00000000046135
Plasmodium vivax copper-transporting ATPase, putative 0.0015 0.0019 0.0388
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0021 0.0051 0.1059
Schistosoma mansoni hypothetical protein 0.0026 0.0081 0.0227
Schistosoma mansoni hypothetical protein 0.0011 0.0001 0.0001
Brugia malayi hypothetical protein 0.0025 0.0073 0.159
Loa Loa (eye worm) hypothetical protein 0.0118 0.0574 1
Echinococcus multilocularis chromobox protein 1 0.0068 0.0306 0.0856
Loa Loa (eye worm) hypothetical protein 0.0081 0.0375 0.6533
Mycobacterium tuberculosis Probable UDP-N-acetylglucosamine 1-carboxyvinyltransferase MurA 0.1346 0.7164 1
Toxoplasma gondii sarco/endoplasmic reticulum Ca2+-ATPase 0.01 0.048 0.1727
Brugia malayi potential phospholipid-transporting ATPase IIB, putative 0.0015 0.0019 0.0408
Leishmania major hypothetical protein, conserved 0.0025 0.0073 0.1421
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0011 0.0001 0.00000000046135
Onchocerca volvulus 0.0081 0.0375 1
Giardia lamblia Potassium-transporting ATPase alpha chain 1 0.0046 0.0189 0.7443
Trichomonas vaginalis MYB3r3, putative 0.0057 0.0246 0.5281
Loa Loa (eye worm) hypothetical protein 0.0026 0.0081 0.1405
Trypanosoma cruzi P-type H+-ATPase, putative 0.0025 0.0077 0.151
Schistosoma mansoni laminin gamma-3 chain 0.0026 0.0081 0.0227
Brugia malayi Animal haem peroxidase family protein 0.0081 0.0375 0.8237
Trypanosoma brucei vacuolar-type Ca2+-ATPase 1 0.005 0.021 0.4509
Entamoeba histolytica calcium-transporting P-type ATPase, putative 0.0053 0.0225 0.9148
Loa Loa (eye worm) hypothetical protein 0.0026 0.0081 0.1405
Onchocerca volvulus 0.0026 0.0081 0.2151
Loa Loa (eye worm) hypothetical protein 0.0026 0.0081 0.1405
Schistosoma mansoni hypothetical protein 0.0026 0.0081 0.0227
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.0057 0.0247 0.5313
Brugia malayi hypothetical protein 0.0081 0.0375 0.8237
Trypanosoma cruzi P-type H+-ATPase, putative 0.0025 0.0077 0.151
Trypanosoma brucei cation-transporting ATPase, putative 0.0015 0.0019 0.0249
Echinococcus granulosus protein jagged 2 0.0026 0.0081 0.0227
Mycobacterium tuberculosis Possible metal cation transporting P-type ATPase CtpH 0.0039 0.0152 0.0186
Echinococcus multilocularis fibropellin Ia 0.0026 0.0081 0.0227
Loa Loa (eye worm) hypothetical protein 0.0081 0.0375 0.6533
Trypanosoma cruzi calcium motive p-type ATPase, putative 0.0048 0.02 0.4213
Trypanosoma cruzi Calcium ATPase SERCA-like 0.0098 0.0465 1
Loa Loa (eye worm) animal heme peroxidase 0.0081 0.0375 0.6533
Leishmania major proton motive ATPase, putative 0.0015 0.0019 0.0244
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0073 0.1509
Entamoeba histolytica hypothetical protein 0.0035 0.0129 0.5254
Brugia malayi EGF-like domain containing protein 0.0026 0.0081 0.1772
Brugia malayi Muscle positioning protein 4 0.0026 0.0081 0.1772
Schistosoma mansoni hypothetical protein 0.0026 0.0081 0.0227
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0011 0.0001 0.00000000046135
Loa Loa (eye worm) hypothetical protein 0.0026 0.0081 0.1405
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.0057 0.0246 0.5281
Echinococcus granulosus phospholipid transporting ATPase IIB 0.0015 0.0019 0.0053
Schistosoma mansoni calcium-transporting atpase 2 (atpase 2) 0.0094 0.0444 0.1242
Brugia malayi Type III restriction enzyme, res subunit family protein 0.0011 0.0001 0.00000000047081
Schistosoma mansoni notch 0.0026 0.0081 0.0227
Entamoeba histolytica cation-transporting P-typeATPase, putative 0.0015 0.0019 0.0758
Schistosoma mansoni copper ABC transporter ATPase 0.0015 0.0019 0.0053
Entamoeba histolytica chromodomain-helicase-DNA-binding protein, putative 0.0011 0.0001 0.00000000087354
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.005 0.021 0.4507
Brugia malayi EGF-like domain containing protein 0.0026 0.0081 0.1772
Loa Loa (eye worm) hypothetical protein 0.0038 0.0145 0.2527
Echinococcus granulosus neural cadherin 0.0026 0.0081 0.0227
Toxoplasma gondii E1-E2 ATPase subfamily protein 0.0019 0.0041 0.0146
Loa Loa (eye worm) hypothetical protein 0.0081 0.0375 0.6533
Mycobacterium ulcerans metal cation transporter p-type ATPase a 0.005 0.021 0.0191
Brugia malayi Peroxidasin 0.0081 0.0375 0.8237
Echinococcus multilocularis notch 0.0026 0.0081 0.0227
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0073 0.1509
Trichomonas vaginalis ATPase, class VI, type 11C, putative 0.0015 0.0019 0.04
Echinococcus multilocularis neurogenic locus notch protein 4 0.0026 0.0081 0.0227
Loa Loa (eye worm) animal heme peroxidase 0.0081 0.0375 0.6533
Echinococcus granulosus bloom syndrome protein 0.0023 0.0067 0.0186
Schistosoma mansoni ATPase 0.0098 0.0465 0.1301
Schistosoma mansoni blooms syndrome DNA helicase 0.0019 0.004 0.0112
Plasmodium vivax calcium-transporting ATPase, putative 0.01 0.048 1
Loa Loa (eye worm) hypothetical protein 0.0019 0.0041 0.0704
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.0129 0.0362
Loa Loa (eye worm) hypothetical protein 0.0025 0.0073 0.1261
Schistosoma mansoni Na+/K+ transporting ATPase subunit alpha 0.0053 0.0225 0.0629
Brugia malayi CHD4 protein 0.0011 0.0001 0.00000000047081
Entamoeba histolytica phospholipid-transporting P-type ATPase, putative 0.0015 0.0019 0.0758
Brugia malayi EGF-like domain containing protein 0.0026 0.0081 0.1772
Trypanosoma brucei PAB1-binding protein , putative 0.0025 0.0073 0.145
Entamoeba histolytica chromodomain-helicase-DNA-binding protein, putative 0.0011 0.0001 0.00000000087354
Brugia malayi EGF-like domain containing protein 0.0026 0.0081 0.1772
Brugia malayi hypothetical protein 0.0035 0.0129 0.2831
Trichomonas vaginalis conserved hypothetical protein 0.0038 0.0145 0.3122
Echinococcus multilocularis neurogenic locus protein delta 0.0026 0.0081 0.0227
Toxoplasma gondii shikimate dehydrogenase substrate binding domain-containing protein 0.0528 0.2777 1
Trichomonas vaginalis pc-MYB2, putative 0.0057 0.0246 0.5281
Loa Loa (eye worm) E1-E2 ATPase 0.0025 0.0077 0.1332
Trichomonas vaginalis MYB, putative 0.0057 0.0247 0.5313
Plasmodium falciparum non-SERCA-type Ca2+ -transporting P-ATPase 0.01 0.048 1
Echinococcus granulosus chromobox protein 1 0.0068 0.0306 0.0856
Brugia malayi Associated with TFs and helicases family protein 0.0011 0.0001 0.00000000047081
Schistosoma mansoni cell polarity protein 0.0026 0.0081 0.0227
Brugia malayi Bloom's syndrome protein homolog 0.0023 0.0067 0.1452
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0053 0.0225 0.4832
Mycobacterium ulcerans cation-transporter ATPase I CtpI 0.0039 0.0152 0.0133
Schistosoma mansoni notch 0.0026 0.0081 0.0227
Loa Loa (eye worm) hypothetical protein 0.0026 0.0081 0.1405
Echinococcus multilocularis protein jagged 2 0.0026 0.0081 0.0227
Giardia lamblia Plasma membrane calcium-transporting ATPase 2 0.005 0.021 0.8361
Brugia malayi chromobox protein homolog 3 0.0038 0.0145 0.3186
Toxoplasma gondii EGF family domain-containing protein 0.0026 0.0081 0.029
Echinococcus multilocularis Na+:K+ ATPase alpha subunit 0.0046 0.0189 0.0528
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0011 0.0001 0.00000000046135
Schistosoma mansoni cation-transporting atpase worm 0.0015 0.0019 0.0053
Brugia malayi Sodium/potassium-transporting ATPase alpha-3 chain, putative 0.0019 0.0041 0.0888
Loa Loa (eye worm) animal heme peroxidase 0.0081 0.0375 0.6533
Trypanosoma brucei P-type H+-ATPase, putative 0.0025 0.0077 0.1541
Echinococcus granulosus plasma membrane calcium transporting ATPase 0.0048 0.02 0.0561
Echinococcus multilocularis cation transporting atpase worm 0.0015 0.0019 0.0053
Brugia malayi Sodium/potassium-transporting ATPase alpha chain, putative 0.0042 0.0167 0.3659
Echinococcus multilocularis slit 2 protein 0.0026 0.0081 0.0227
Onchocerca volvulus 0.0026 0.0081 0.2151
Echinococcus granulosus chromobox protein 1 0.0068 0.0306 0.0856
Brugia malayi Calcium-transporting ATPase sarcoplasmic/endoplasmic reticulum type 0.0096 0.0456 1
Loa Loa (eye worm) hypothetical protein 0.0026 0.0081 0.1405
Echinococcus granulosus plasma membrane calcium transporting ATPase 2 0.0053 0.0225 0.0629
Mycobacterium leprae PROBABLE CATION-TRANSPORTER ATPASE I CTPI 0.0039 0.0152 0.0186
Toxoplasma gondii heavy metal translocating P-type ATPase subfamily protein 0.0015 0.0019 0.0067
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0011 0.0001 0.00000000046135
Echinococcus granulosus Chromobox protein 3 0.0011 0.0001 0.0001
Loa Loa (eye worm) heterochromatin protein 1 0.0068 0.0306 0.5325
Trypanosoma brucei calcium-transporting ATPase, putative 0.0038 0.0143 0.3008
Echinococcus granulosus protein jagged 2 0.0026 0.0081 0.0227
Giardia lamblia High cysteine protein 0.0026 0.0081 0.272
Loa Loa (eye worm) hypothetical protein 0.0081 0.0375 0.6533
Echinococcus granulosus protein jagged 1 0.0026 0.0081 0.0227
Plasmodium vivax P-type ATPase4, putative 0.01 0.048 1
Brugia malayi Heterochromatin protein 1 0.0068 0.0306 0.6714
Schistosoma mansoni notch 0.0026 0.0081 0.0227
Leishmania major copper-transporting ATPase-like protein, putative 0.0015 0.0019 0.0244
Loa Loa (eye worm) blistered cuticle protein 3 0.0081 0.0375 0.6533
Schistosoma mansoni notch 0.0026 0.0081 0.0227
Echinococcus multilocularis neurogenic locus notch protein 0.0026 0.0081 0.0227
Schistosoma mansoni type V p-type atpase isoform 0.0015 0.0019 0.0053
Loa Loa (eye worm) hypothetical protein 0.0011 0.0001 0.00000000037338
Entamoeba histolytica Plasma membrane calcium-transporting ATPase, putative 0.005 0.021 0.8533
Trypanosoma cruzi copper-transporting ATPase-like protein, putative 0.0015 0.0019 0.0244
Schistosoma mansoni calcium-transporting atpase sarcoplasmic/endoplasmic reticulum type (calcium pump) 0.0096 0.0456 0.1275
Schistosoma mansoni septate junction protein 0.0026 0.0081 0.0227
Loa Loa (eye worm) sodium potassium adenosine triphosphatase 0.0019 0.0041 0.0704
Loa Loa (eye worm) hypothetical protein 0.0026 0.0081 0.1405
Schistosoma mansoni chromobox protein-related (chromobox 1) (heterochromatin 1) 0.0011 0.0001 0.0001
Echinococcus granulosus cation transporting ATPase 13A3 0.0015 0.0019 0.0053
Echinococcus granulosus neurogenic locus notch protein 0.0026 0.0081 0.0227
Leishmania major P-type ATPase, putative 0.0048 0.02 0.4213
Trichomonas vaginalis cation-transporting ATPase, putative 0.0025 0.0077 0.1646

Activities

Activity type Activity value Assay description Source Reference
Inhibition (binding) = 48 % Inhibition of HIV1 protease at 5 uM ChEMBL. 17181152
Inhibition (binding) = 48 % Inhibition of HIV1 protease at 5 uM ChEMBL. 17181152

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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