Detailed information for compound 601663

Basic information

Technical information
  • TDR Targets ID: 601663
  • Name: T5227594
  • MW: 348.791 | Formula: C16H20ClF3N2O
  • H donors: 2 H acceptors: 1 LogP: 4.58 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(Nc1cc(ccc1Cl)C(F)(F)F)CNCC1CCCCC1
  • InChi: 1S/C16H20ClF3N2O/c17-13-7-6-12(16(18,19)20)8-14(13)22-15(23)10-21-9-11-4-2-1-3-5-11/h6-8,11,21H,1-5,9-10H2,(H,22,23)
  • InChiKey: WMHBCHCQKFJMIX-UHFFFAOYSA-N  


Substructure search Similarity search

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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
Onchocerca volvulus 0.0027 0.0119 0.0242
Echinococcus multilocularis polycomb protein SCMH1 0.005 0.0306 0.0494
Echinococcus multilocularis ecdysone induced protein 78C 0.0023 0.008 0.0087
Loa Loa (eye worm) hypothetical protein 0.0023 0.008 0.0087
Brugia malayi Smad1 0.0017 0.0039 0.0033
Onchocerca volvulus Alhambra homolog 0.0032 0.0155 0.0472
Mycobacterium ulcerans beta-lactamase 0.0194 0.1478 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0027 0.0119 0.0156
Loa Loa (eye worm) MH1 domain-containing protein 0.0017 0.0039 0.0012
Loa Loa (eye worm) acetyltransferase 0.0159 0.1191 0.2091
Brugia malayi beta-lactamase family protein 0.0194 0.1478 0.7413
Schistosoma mansoni ap endonuclease 0.002 0.0056 0.0043
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.002 0.0056 0.0043
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0101 0.0721 0.1243
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0023 0.008 0.0087
Plasmodium falciparum importin beta, putative 0.0065 0.0428 1
Echinococcus multilocularis beta LACTamase domain containing family member 0.0194 0.1478 0.2607
Trichomonas vaginalis CAMK family protein kinase 0.0055 0.0347 0.1818
Echinococcus granulosus lysine specific demethylase 5A 0.0038 0.0209 0.032
Loa Loa (eye worm) MH2 domain-containing protein 0.0256 0.1982 0.3517
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0194 0.1478 0.2607
Echinococcus granulosus snurportin 1 0.0697 0.5577 1
Echinococcus multilocularis PHD finger protein rhinoceros 0.0032 0.0155 0.0222
Echinococcus multilocularis peregrin 0.0036 0.0187 0.0279
Entamoeba histolytica serine/threonine protein kinase, putative 0.0112 0.0807 1
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0202 0.1543 0.2724
Brugia malayi photoreceptor-specific nuclear receptor 0.0023 0.008 0.0248
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0114 0.0824 0.1428
Schistosoma mansoni smad 0.0017 0.0039 0.0012
Entamoeba histolytica hypothetical protein 0.0053 0.0328 0.3619
Loa Loa (eye worm) hypothetical protein 0.0036 0.019 0.0284
Plasmodium falciparum histone acetyltransferase GCN5 0.0043 0.0246 0.5089
Brugia malayi Pre-SET motif family protein 0.019 0.1445 0.7246
Mycobacterium tuberculosis Conserved protein 0.0194 0.1478 0.143
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0023 0.008 0.0248
Schistosoma mansoni jumonji domain containing protein 0.0083 0.0569 0.0969
Trichomonas vaginalis CAMK family protein kinase 0.0112 0.0807 0.4688
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0023 0.008 0.0087
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0101 0.0721 0.3533
Plasmodium vivax hypothetical protein, conserved 0.0032 0.0155 0.0697
Brugia malayi Importin beta-1 subunit 0.0065 0.0428 0.2033
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0104 0.0743 0.1283
Toxoplasma gondii PHD-finger domain-containing protein 0.0032 0.0155 0.0697
Brugia malayi MH1 domain containing protein 0.0017 0.0039 0.0033
Brugia malayi Calcitonin receptor-like protein seb-1 0.0053 0.0325 0.1503
Schistosoma mansoni ran 0.0048 0.0288 0.0462
Loa Loa (eye worm) hypothetical protein 0.0194 0.1478 0.2607
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0194 0.1478 0.2607
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0023 0.008 0.0087
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0114 0.0824 0.1428
Echinococcus multilocularis histone acetyltransferase MYST2 0.0057 0.0363 0.0596
Schistosoma mansoni coup transcription factor 0.0023 0.008 0.0087
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0023 0.008 0.0087
Mycobacterium tuberculosis Conserved protein 0.0194 0.1478 0.143
Schistosoma mansoni hypothetical protein 0.031 0.2418 0.4304
Trypanosoma brucei hypothetical protein, conserved 0.0194 0.1478 1
Loa Loa (eye worm) hypothetical protein 0.0027 0.0119 0.0156
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.019 0.1445 0.2549
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0114 0.0824 0.406
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0112 0.0807 0.1398
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0027 0.0119 0.0156
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0023 0.008 0.0087
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0023 0.008 0.0087
Echinococcus multilocularis jumonji domain containing protein 0.0044 0.0256 0.0404
Loa Loa (eye worm) MH2 domain-containing protein 0.0017 0.0039 0.0012
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0023 0.008 0.0087
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0039 0.0218 0.0335
Trypanosoma cruzi importin beta-1 subunit, putative 0.0053 0.0328 0.1913
Onchocerca volvulus 0.005 0.0306 0.1429
Schistosoma mansoni sex comb on midleg homolog 0.005 0.0306 0.0494
Echinococcus granulosus geminin 0.0358 0.2812 0.5013
Trichomonas vaginalis CAMK family protein kinase 0.0112 0.0807 0.4688
Brugia malayi MH2 domain containing protein 0.0017 0.0039 0.0033
Brugia malayi Bromodomain containing protein 0.0036 0.0187 0.0793
Mycobacterium tuberculosis Probable esterase LipL 0.0194 0.1478 0.143
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0023 0.008 0.0087
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0057 0.0363 0.1695
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0053 0.0328 0.1696
Schistosoma mansoni hypothetical protein 0.0036 0.019 0.0284
Loa Loa (eye worm) jmjC domain-containing protein 0.0038 0.0209 0.032
Brugia malayi MH2 domain containing protein 0.0256 0.1982 1
Leishmania major hypothetical protein, conserved 0.0194 0.1478 1
Echinococcus granulosus polycomb protein SCMH1 0.005 0.0306 0.0494
Trichomonas vaginalis D-aminoacylase, putative 0.0194 0.1478 0.8869
Echinococcus granulosus FTZ F1 alpha 0.0452 0.3581 0.64
Giardia lamblia PHD finger protein 15 0.0032 0.0155 0.1319
Brugia malayi exodeoxyribonuclease III family protein 0.002 0.0056 0.0122
Mycobacterium tuberculosis Conserved protein 0.0194 0.1478 0.143
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0101 0.0721 0.1243
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0159 0.1191 0.2091
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0023 0.008 0.0087
Treponema pallidum exodeoxyribonuclease (exoA) 0.002 0.0056 0.5
Loa Loa (eye worm) hypothetical protein 0.005 0.0306 0.0494
Trypanosoma cruzi hypothetical protein, conserved 0.0194 0.1478 1
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0023 0.008 0.0087
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0048 0.0288 0.1633
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0202 0.1543 0.2724
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0023 0.008 0.0087
Echinococcus granulosus TGF beta signal transducer SmadC 0.0017 0.0039 0.0012
Schistosoma mansoni sex comb on midleg homolog 0.005 0.0306 0.0494
Loa Loa (eye worm) hypothetical protein 0.0194 0.1478 0.2607
Brugia malayi PHD-finger family protein 0.0032 0.0155 0.063
Onchocerca volvulus Serine\/threonine kinase homolog 0.0112 0.0807 0.4605
Loa Loa (eye worm) hypothetical protein 0.0023 0.008 0.0087
Mycobacterium ulcerans hypothetical protein 0.0194 0.1478 1
Schistosoma mansoni jumonji/arid domain-containing protein 0.0038 0.0209 0.032
Echinococcus granulosus Smad4 0.0017 0.0039 0.0012
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0101 0.0721 0.1243
Brugia malayi Steroid receptor seven-up type 2 0.0023 0.008 0.0248
Schistosoma mansoni hypothetical protein 0.0039 0.0218 0.0335
Schistosoma mansoni transcription factor LCR-F1 0.0039 0.0218 0.0335
Echinococcus granulosus beta LACTamase domain containing family member 0.0194 0.1478 0.2607
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0023 0.008 0.0248
Brugia malayi ecdysteroid receptor 0.0023 0.008 0.0248
Loa Loa (eye worm) steroid hormone receptor 0.0023 0.008 0.0087
Leishmania major GTP-binding protein, putative 0.0048 0.0288 0.1633
Echinococcus granulosus ecdysone induced protein 78C 0.0023 0.008 0.0087
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0017 0.0039 0.0012
Trichomonas vaginalis bromodomain-containing protein, putative 0.0047 0.0277 0.1381
Brugia malayi beta-lactamase 0.0194 0.1478 0.7413
Echinococcus granulosus SAM and MBT domain containing protein 0.005 0.0306 0.0494
Echinococcus multilocularis mothers against decapentaplegic 5 0.0017 0.0039 0.0012
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0027 0.0119 0.0441
Loa Loa (eye worm) Smad1 0.0017 0.0039 0.0012
Echinococcus granulosus importin subunit beta 1 0.0065 0.0428 0.0715
Mycobacterium tuberculosis Probable hydrolase 0.0194 0.1478 0.143
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0027 0.0119 0.0156
Loa Loa (eye worm) hypothetical protein 0.0065 0.0428 0.0715
Plasmodium vivax SET domain protein, putative 0.0027 0.0119 0.0441
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0194 0.1478 0.143
Schistosoma mansoni hypothetical protein 0.0091 0.064 0.1096
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.002 0.0056 0.5
Trypanosoma cruzi polo-like protein kinase, putative 0.0112 0.0807 0.5285
Schistosoma mansoni smad1 5 8 and 0.0017 0.0039 0.0012
Brugia malayi acetyltransferase, GNAT family protein 0.0159 0.1191 0.5945
Schistosoma mansoni thyroid hormone receptor 0.0023 0.008 0.0087
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0026 0.011 0.0141
Brugia malayi jmjC domain containing protein 0.0104 0.0743 0.3647
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0023 0.008 0.0248
Schistosoma mansoni myelin transcription factor 1 myt1 0.0057 0.0363 0.0596
Loa Loa (eye worm) hypothetical protein 0.0054 0.034 0.0555
Loa Loa (eye worm) hypothetical protein 0.0194 0.1478 0.2607
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0032 0.0155 0.0222
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0027 0.0119 0.0156
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0017 0.0039 0.0012
Brugia malayi mbt repeat family protein 0.005 0.0306 0.1404
Toxoplasma gondii HEAT repeat-containing protein 0.0065 0.0428 0.2621
Entamoeba histolytica hypothetical protein 0.0039 0.0218 0.2155
Loa Loa (eye worm) beta-lactamase 0.0194 0.1478 0.2607
Toxoplasma gondii PHD-finger domain-containing protein 0.0032 0.0155 0.0697
Echinococcus granulosus peregrin 0.0036 0.0187 0.0279
Echinococcus multilocularis importin subunit beta 1 0.0065 0.0428 0.0715
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0194 0.1478 0.143
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0023 0.008 0.0087
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0048 0.0288 0.1633
Mycobacterium tuberculosis Probable lipase LipD 0.0194 0.1478 0.143
Loa Loa (eye worm) hypothetical protein 0.0023 0.008 0.0087
Echinococcus granulosus PHD finger protein rhinoceros 0.0032 0.0155 0.0222
Onchocerca volvulus 0.0194 0.1478 0.8851
Echinococcus multilocularis geminin 0.0358 0.2812 0.5013
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0114 0.0824 0.1428
Echinococcus granulosus jumonji domain containing protein 0.0044 0.0256 0.0404
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0023 0.008 0.0248
Trichomonas vaginalis CAMK family protein kinase 0.0112 0.0807 0.4688
Loa Loa (eye worm) mbt repeat family protein 0.005 0.0306 0.0494
Brugia malayi latrophilin 2 splice variant baaae 0.0036 0.019 0.0807
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0023 0.008 0.0087
Schistosoma mansoni ran 0.0048 0.0288 0.0462
Echinococcus multilocularis SAM and MBT domain containing protein 0.005 0.0306 0.0494
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0194 0.1478 0.143
Trichomonas vaginalis D-aminoacylase, putative 0.0194 0.1478 0.8869
Loa Loa (eye worm) hypothetical protein 0.0023 0.008 0.0087
Schistosoma mansoni hypothetical protein 0.0358 0.2812 0.5013
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0194 0.1478 0.7413
Plasmodium falciparum phd finger protein, putative 0.0032 0.0155 0.266
Entamoeba histolytica Ran family GTPase 0.0048 0.0288 0.3089
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0023 0.008 0.0087
Trichomonas vaginalis CAMK family protein kinase 0.0112 0.0807 0.4688
Schistosoma mansoni nuclear hormone receptor 0.0023 0.008 0.0087
Loa Loa (eye worm) hypothetical protein 0.0053 0.0325 0.0529
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0053 0.0325 0.0529
Trichomonas vaginalis set domain proteins, putative 0.0216 0.1659 1
Trypanosoma brucei polo-like protein kinase 0.0112 0.0807 0.5464
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0047 0.0277 0.1557
Brugia malayi Nuclear hormone receptor-like 1 0.0023 0.008 0.0248
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0048 0.0288 0.1949
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0023 0.008 0.0087
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0048 0.0288 0.1633
Onchocerca volvulus 0.0194 0.1478 0.8851
Echinococcus multilocularis Smad4 0.0017 0.0039 0.0012
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0048 0.0288 0.0462
Echinococcus multilocularis FTZ F1 alpha 0.0114 0.0824 0.1428
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0053 0.0328 0.1696
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0104 0.0743 0.1283
Trichomonas vaginalis CAMK family protein kinase 0.0112 0.0807 0.4688
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.005 0.0306 0.0494
Echinococcus multilocularis thyroid hormone receptor alpha 0.0023 0.008 0.0087
Schistosoma mansoni jumonji/arid domain-containing protein 0.0038 0.0209 0.032
Trichomonas vaginalis importin beta-1, putative 0.0053 0.0328 0.1696
Loa Loa (eye worm) hypothetical protein 0.0194 0.1478 0.2607
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0023 0.008 0.0248
Brugia malayi Pre-SET motif family protein 0.0027 0.0119 0.0443
Trichomonas vaginalis penicillin-binding protein, putative 0.0194 0.1478 0.8869
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.002 0.0056 0.0043
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0112 0.0807 0.1398
Echinococcus granulosus mothers against decapentaplegic 5 0.0017 0.0039 0.0012
Trichomonas vaginalis CAMK family protein kinase 0.0112 0.0807 0.4688
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0023 0.008 0.0248
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0697 0.5577 1
Schistosoma mansoni hypothetical protein 0.0032 0.0155 0.0222
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0112 0.0807 0.1398
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0023 0.008 0.0248
Trichomonas vaginalis esterase, putative 0.0194 0.1478 0.8869
Loa Loa (eye worm) hypothetical protein 0.0194 0.1478 0.2607
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0023 0.008 0.0087
Trypanosoma cruzi polo-like protein kinase, putative 0.0112 0.0807 0.5285
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0023 0.008 0.0248
Toxoplasma gondii ABC1 family protein 0.0194 0.1478 1
Schistosoma mansoni importin beta-1 0.0065 0.0428 0.0715
Mycobacterium tuberculosis Probable lipase LipE 0.0194 0.1478 0.143
Brugia malayi MH2 domain containing protein 0.0017 0.0039 0.0033
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0023 0.008 0.0087
Brugia malayi serine/threonine-protein kinase plk-2 0.0112 0.0807 0.3976
Loa Loa (eye worm) hypothetical protein 0.0194 0.1478 0.2607
Trichomonas vaginalis CAMK family protein kinase 0.0112 0.0807 0.4688
Schistosoma mansoni thyroid hormone receptor 0.0023 0.008 0.0087
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0023 0.008 0.0087
Loa Loa (eye worm) MBCTL1 0.0057 0.0363 0.0596
Plasmodium vivax importin-beta 2, putative 0.0065 0.0428 0.2621
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0057 0.0363 0.0596
Schistosoma mansoni ap endonuclease 0.002 0.0056 0.0043
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0194 0.1478 0.2607
Loa Loa (eye worm) hypothetical protein 0.0023 0.008 0.0087
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0101 0.0721 0.1243
Loa Loa (eye worm) hypothetical protein 0.0032 0.0155 0.0222
Trichomonas vaginalis D-aminoacylase, putative 0.0194 0.1478 0.8869
Echinococcus granulosus histone acetyltransferase MYST2 0.0057 0.0363 0.0596
Mycobacterium leprae conserved hypothetical protein 0.0194 0.1478 0.5
Loa Loa (eye worm) hypothetical protein 0.0023 0.008 0.0087
Loa Loa (eye worm) hypothetical protein 0.0114 0.0824 0.1428
Schistosoma mansoni serine/threonine protein kinase 0.0112 0.0807 0.1398
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0057 0.0363 0.0596
Trichomonas vaginalis ran, putative 0.0048 0.0288 0.1448
Schistosoma mansoni hypothetical protein 0.0697 0.5577 1
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0048 0.0288 0.1312
Brugia malayi RNA, U transporter 1 0.0186 0.141 0.7063
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0047 0.0277 0.1557
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0039 0.0218 0.0335
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0047 0.0277 0.1381
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0048 0.0288 0.3089
Schistosoma mansoni RAR-like nuclear receptor 0.0023 0.008 0.0087
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0047 0.0277 0.1557
Schistosoma mansoni smad1 5 8 and 0.0017 0.0039 0.0012
Brugia malayi hypothetical protein 0.0039 0.0218 0.0952
Schistosoma mansoni smad1 5 8 and 0.0017 0.0039 0.0012
Onchocerca volvulus 0.0216 0.1659 1
Echinococcus multilocularis lysine specific demethylase 5A 0.0038 0.0209 0.032
Onchocerca volvulus 0.0194 0.1478 0.8851
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0053 0.0325 0.1503
Entamoeba histolytica hypothetical protein 0.0039 0.0218 0.2155
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0027 0.0119 0.0156
Schistosoma mansoni hypothetical protein 0.0358 0.2812 0.5013
Echinococcus granulosus histone acetyltransferase KAT2B 0.0154 0.1155 0.2025
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.005 0.0306 0.1429
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0194 0.1478 1
Echinococcus granulosus histone lysine methyltransferase setb 0.0027 0.0119 0.0156
Loa Loa (eye worm) transcription factor SMAD2 0.0256 0.1982 0.3517
Brugia malayi beta-lactamase family protein 0.0194 0.1478 0.7413
Entamoeba histolytica hypothetical protein 0.0039 0.0218 0.2155
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0114 0.0824 0.406
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0048 0.0288 0.0462
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0023 0.008 0.0248
Brugia malayi mbt repeat family protein 0.005 0.0306 0.1404
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0048 0.0288 0.623
Brugia malayi MH1 domain containing protein 0.0017 0.0039 0.0033
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0101 0.0721 0.1243
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0112 0.0807 0.5285
Giardia lamblia Kinase, PLK 0.0112 0.0807 1
Schistosoma mansoni steroid hormone receptor ad4bp 0.0023 0.008 0.0087
Loa Loa (eye worm) PHD-finger family protein 0.0032 0.0155 0.0222
Loa Loa (eye worm) hypothetical protein 0.0023 0.008 0.0087
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0023 0.008 0.0087
Trichomonas vaginalis penicillin-binding protein, putative 0.0194 0.1478 0.8869
Schistosoma mansoni kinase 0.0057 0.0359 0.059
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0101 0.0721 0.1243
Trypanosoma brucei importin beta-1 subunit, putative 0.0065 0.0428 0.2899
Mycobacterium ulcerans lipase LipD 0.0194 0.1478 1
Entamoeba histolytica hypothetical protein 0.0039 0.0218 0.2155
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.002 0.0056 0.0378
Trypanosoma brucei importin beta-1 subunit, putative 0.0065 0.0428 0.2899
Brugia malayi jmjC domain containing protein 0.0038 0.0209 0.0909
Echinococcus multilocularis snurportin 1 0.0697 0.5577 1
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0023 0.008 0.0248
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0023 0.008 0.0087
Brugia malayi nuclear receptor NHR-88 0.0023 0.008 0.0248
Echinococcus multilocularis smad 0.0017 0.0039 0.0012
Mycobacterium ulcerans esterase/lipase LipP 0.0194 0.1478 1
Loa Loa (eye worm) hypothetical protein 0.0057 0.0363 0.0596
Schistosoma mansoni retinoic acid receptor RXR 0.0023 0.008 0.0087
Giardia lamblia Histone acetyltransferase GCN5 0.0043 0.0246 0.2523
Schistosoma mansoni Smad4 0.0017 0.0039 0.0012
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0101 0.0721 0.1243
Brugia malayi nuclear hormone receptor 0.0023 0.008 0.0248
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0023 0.008 0.0087
Leishmania major importin beta-1 subunit, putative 0.0053 0.0328 0.1913
Loa Loa (eye worm) jmjC domain-containing protein 0.0066 0.043 0.0718
Echinococcus granulosus GTP binding nuclear protein Ran 0.0048 0.0288 0.0462
Mycobacterium leprae Probable lipase LipE 0.0194 0.1478 0.5
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0023 0.008 0.0087
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0027 0.0119 0.0156
Echinococcus granulosus smad 0.0017 0.0039 0.0012
Plasmodium vivax hypothetical protein, conserved 0.0194 0.1478 1
Entamoeba histolytica acetyltransferase, GNAT family 0.0043 0.0246 0.2523
Brugia malayi steroid hormone receptor 0.0023 0.008 0.0248
Echinococcus granulosus histone acetyltransferase KAT2B 0.0047 0.0277 0.0442
Trichomonas vaginalis CAMK family protein kinase 0.0055 0.0347 0.1818
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0159 0.1191 0.2091
Trypanosoma cruzi hypothetical protein, conserved 0.0194 0.1478 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0023 0.008 0.0087
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0023 0.008 0.0248
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0101 0.0721 0.1243
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.002 0.0056 0.0043
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0048 0.0288 0.1633

Activities

Activity type Activity value Assay description Source Reference
Inhibition (functional) = 0.51 % ST_JUDE_LEISH: Cytotoxicity at 2uM final concentration against transgenic Leishmania Mexicana promastigotes LmPfHT that are glucose transport deficient and complemented with the Plasmodium falciparum hexose transporter. Activity is measured by by DNA content using SYBR green in vitro ChEMBL. No reference
Inhibition (functional) = 1 % GSK_TCMDC: Percent inhibition of human HepG2 cell line. Test compounds present at 10uM. ChEMBL. 20485427
Inhibition (functional) = 1.07 % ST_JUDE_LEISH: Cytotoxicity at 2uM final concentration against transgenic Leishmania Mexicana promastigotes LmGT2 that are glucose transport deficient and complemented with the L. Mexicana glucose transporter 2. Activity is measured by by DNA content using SYBR green in vitro ChEMBL. No reference
Inhibition (functional) = 1.93 % ST_JUDE_LEISH: Cytotoxicity at 2uM final concentration against transgenic Leishmania Mexicana promastigotes LmGLUT1 that are glucose transport deficient and complemented with the human glucose transporter GLUT1. Activity is measured by DNA content using SYBR green in vitro ChEMBL. No reference
Inhibition (functional) = 2 % GSK_TCMDC: Inhibition of Plasmodium falciparum 3D7 LDH activity, using an LDH reporter assay. Test compounds present at 2uM ChEMBL. 20485427
Inhibition (functional) = 67 % GSK_TCMDC: Inhibition of Plasmodium falciparum Dd2 in whole red blood cells, using parasite LDH activity as an index of growth. Test compounds present at 2uM ChEMBL. 20485427
Inhibition (functional) = 86 % GSK_TCMDC: Inhibition of Plasmodium falciparum 3D7 in whole red blood cells, using parasite LDH activity as an index of growth. Test compounds present at 2uM ChEMBL. 20485427
Inhibition frequency index (IFI) (functional) = 4.23 Inhibition Frequency Index (IFI) GSK. 20485427
Percent growth inhibition (functional) = 1 % Percent inhibition of HepG2 growth (at 10 uM) GSK. 20485427
Percent growth inhibition (functional) = 2 % Percent inhibition of P. falciparum lactate dehydrogenase activity (at 2 uM) GSK. 20485427
Percent growth inhibition (functional) = 67 % Percent inhibition of P. falciparum Dd2 growth (at 2 uM) GSK. 20485427
Percent growth inhibition (functional) = 86 % Percent inhibition of P. falciparum 3D7 growth (at 2 uM) GSK. 20485427
XC50 (functional) = 6.01 XC50 determination of P. falciparum 3D7 growth GSK. 20485427
XC50 (functional) = 0.98155 uM GSK_TCMDC: Inhibition of Plasmodium falciparum 3D7 in whole erythrocytes, using parasite LDH activity as an index of growth. ChEMBL. 20485427

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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