Detailed information for compound 106279

Basic information

Technical information
  • TDR Targets ID: 106279
  • Name: 2-[7-[3-(diaminomethylideneamino)propoxy]-1-o xo-3,4-dihydroisoquinolin-2-yl]acetic acid
  • MW: 320.344 | Formula: C15H20N4O4
  • H donors: 3 H acceptors: 3 LogP: 0.17 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: NC(=N)NCCCOc1ccc2c(c1)C(=O)N(CC2)CC(=O)O
  • InChi: 1S/C15H20N4O4/c16-15(17)18-5-1-7-23-11-3-2-10-4-6-19(9-13(20)21)14(22)12(10)8-11/h2-3,8H,1,4-7,9H2,(H,20,21)(H4,16,17,18)
  • InChiKey: BDNRWQDKTWLRRO-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-[7-(3-guanidinopropoxy)-1-oxo-3,4-dihydroisoquinolin-2-yl]acetic acid
  • 2-[7-[3-[bis(azanyl)methylideneamino]propoxy]-1-oxo-3,4-dihydroisoquinolin-2-yl]ethanoic acid
  • 2-[7-(3-guanidinopropoxy)-1-keto-3,4-dihydroisoquinolin-2-yl]acetic acid
  • 2-[7-[3-(diaminomethylideneamino)propoxy]-1-oxo-3,4-dihydroisoquinolin-2-yl]ethanoic acid

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 Pyruvate kinase, muscle isozyme 0.003 0.0262 0.051
Leishmania major pyruvate kinase 0.003 0.0262 0.6032
Loa Loa (eye worm) hypothetical protein 0.0042 0.0425 0.0898
Loa Loa (eye worm) hypothetical protein 0.0354 0.4731 1
Toxoplasma gondii beta-tubulin, putative 0.0014 0.0042 0.1101
Echinococcus granulosus fetal alzheimer antigen falz 0.002 0.0114 0.0134
Echinococcus multilocularis microtubule associated protein 2 0.0626 0.8487 0.8487
Echinococcus granulosus beta tubulin 0.0014 0.0042 0.0049
Schistosoma mansoni methyl-cpg binding protein mbd 0.0015 0.0048 0.004
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0042 0.0425 1
Trypanosoma cruzi STE/STE11 serine/threonine-protein kinase, putative 0.0026 0.0197 0.7361
Schistosoma mansoni zinc finger protein 0.0017 0.0078 0.0075
Loa Loa (eye worm) AMP-binding enzyme family protein 0.0012 0.0015 0.0031
Echinococcus granulosus pyruvate kinase 0.0016 0.0059 0.0069
Loa Loa (eye worm) RNA binding protein 0.0055 0.0602 0.1273
Leishmania major protein kinase, putative 0.0026 0.0197 0.444
Schistosoma mansoni tar DNA-binding protein 0.0055 0.0602 0.0693
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0031 0.0274 0.0274
Loa Loa (eye worm) hypothetical protein 0.006 0.0679 0.1435
Echinococcus granulosus aryl hydrocarbon receptor 0.0026 0.0197 0.0232
Echinococcus multilocularis Tubulin beta 2C chain 0.0014 0.0042 0.0042
Loa Loa (eye worm) hypothetical protein 0.0015 0.0048 0.0102
Schistosoma mansoni lamin 0.0023 0.0167 0.018
Brugia malayi hypothetical protein 0.033 0.4395 0.9024
Echinococcus multilocularis beta tubulin 0.0014 0.0042 0.0042
Leishmania major 4-coumarate:coa ligase-like protein 0.0042 0.0425 1
Loa Loa (eye worm) BEN-1 protein 0.0014 0.0042 0.0089
Entamoeba histolytica tubulin family protein 0.0014 0.0042 0.0664
Schistosoma mansoni zinc finger protein 0.0013 0.0027 0.0015
Onchocerca volvulus Pyruvate kinase homolog 0.003 0.0262 0.0655
Echinococcus granulosus Tubulin beta 2C chain 0.0014 0.0042 0.0049
Trichomonas vaginalis soluble guanylate cyclase gcy, putative 0.0026 0.0197 0.7361
Schistosoma mansoni tubulin subunit beta 0.0014 0.0042 0.0032
Loa Loa (eye worm) intermediate filament protein 0.0023 0.0167 0.0353
Brugia malayi Calcitonin receptor-like protein seb-1 0.0088 0.1065 0.2164
Leishmania major hypothetical protein, conserved 0.0013 0.0027 0.0306
Schistosoma mansoni tar DNA-binding protein 0.0055 0.0602 0.0693
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.003 0.0254 0.5844
Plasmodium vivax tubulin beta chain, putative 0.0014 0.0042 0.1034
Trichomonas vaginalis tubulin epsilon chain, putative 0.0014 0.0042 0.1101
Echinococcus multilocularis zinc finger protein 0.0017 0.0078 0.0078
Echinococcus granulosus Tubulin beta 2C chain 0.0014 0.0042 0.0049
Echinococcus granulosus lamin dm0 0.0023 0.0167 0.0197
Trypanosoma brucei beta tubulin 0.0014 0.0042 0.1101
Leishmania major 4-coumarate:coa ligase-like protein 0.0042 0.0425 1
Trichomonas vaginalis tubulin epsilon chain, putative 0.0014 0.0042 0.1101
Plasmodium falciparum pyruvate kinase 0.003 0.0262 0.9393
Loa Loa (eye worm) bromodomain containing protein 0.0015 0.0056 0.0118
Brugia malayi Pyruvate kinase, M2 isozyme 0.003 0.0262 0.051
Schistosoma mansoni hypothetical protein 0.0028 0.0231 0.0255
Schistosoma mansoni hypothetical protein 0.0028 0.0231 0.0255
Trypanosoma cruzi pyruvate kinase 2, putative 0.003 0.0262 1
Echinococcus multilocularis pyruvate kinase 0.003 0.0262 0.0262
Schistosoma mansoni hypothetical protein 0.0018 0.0091 0.009
Schistosoma mansoni microtubule-associated protein tau 0.0626 0.8487 1
Trichomonas vaginalis pyruvate kinase, putative 0.003 0.0262 1
Loa Loa (eye worm) hypothetical protein 0.0031 0.0278 0.0588
Echinococcus multilocularis Tubulin beta 2C chain 0.0014 0.0042 0.0042
Echinococcus multilocularis Tubulin beta 2C chain 0.0014 0.0042 0.0042
Echinococcus multilocularis acetyl coenzyme A synthetase, cytoplasmic 0.0012 0.0015 0.0015
Leishmania major pyruvate kinase 0.003 0.0262 0.6032
Loa Loa (eye worm) TK/ALK protein kinase 0.014 0.1781 0.3766
Trypanosoma cruzi STE group serine/threonine-protein kinase, putative 0.0026 0.0197 0.7361
Schistosoma mansoni tar DNA-binding protein 0.0055 0.0602 0.0693
Loa Loa (eye worm) hypothetical protein 0.0031 0.0278 0.0588
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0015 0.0048 0.0048
Plasmodium vivax pyruvate kinase 2, putative 0.0016 0.0059 0.1671
Loa Loa (eye worm) hypoxia-induced factor 1 0.0304 0.4042 0.8545
Schistosoma mansoni hypothetical protein 0.0013 0.0027 0.0015
Echinococcus multilocularis tar DNA binding protein 0.0055 0.0602 0.0602
Mycobacterium ulcerans putative regulatory protein 0.0073 0.0848 1
Onchocerca volvulus 0.0042 0.0425 0.1086
Trichomonas vaginalis guanylate cyclase, putative 0.0026 0.0197 0.7361
Leishmania major beta tubulin 0.0014 0.0042 0.0664
Brugia malayi latrophilin 2 splice variant baaae 0.006 0.0679 0.1368
Chlamydia trachomatis pyruvate kinase 0.003 0.0262 0.8034
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0028 0.0231 0.0231
Trichomonas vaginalis adenylate cyclase, putative 0.0026 0.0197 0.7361
Echinococcus granulosus histone lysine methyltransferase setb 0.0015 0.0048 0.0057
Brugia malayi AMP-binding enzyme family protein 0.0042 0.0425 0.0845
Brugia malayi hypothetical protein 0.0286 0.3789 0.7777
Echinococcus granulosus intermediate filament protein 0.0023 0.0167 0.0197
Loa Loa (eye worm) hypothetical protein 0.0123 0.1542 0.3259
Echinococcus multilocularis musashi 0.0023 0.0167 0.0167
Leishmania major beta tubulin 0.0014 0.0042 0.0664
Trichomonas vaginalis tubulin gamma chain, putative 0.0014 0.0042 0.1101
Trypanosoma cruzi PAS-domain containing phosphoglycerate kinase, putative 0.0026 0.0197 0.7361
Echinococcus multilocularis tumor protein p63 0.0307 0.4076 0.4076
Loa Loa (eye worm) AMP-binding enzyme family protein 0.0012 0.0015 0.0031
Loa Loa (eye worm) hypothetical protein 0.0031 0.0278 0.0588
Entamoeba histolytica pyruvate kinase, putative 0.0021 0.0136 0.2949
Echinococcus multilocularis pyruvate kinase 0.0024 0.0174 0.0174
Echinococcus granulosus microtubule associated protein 2 0.0626 0.8487 1
Schistosoma mansoni tubulin subunit beta 0.0014 0.0042 0.0032
Onchocerca volvulus 0.0023 0.0167 0.0403
Trichomonas vaginalis conserved hypothetical protein 0.0026 0.0197 0.7361
Echinococcus multilocularis pyruvate kinase 0.0016 0.0059 0.0059
Trypanosoma cruzi beta tubulin, putative 0.0014 0.0042 0.1101
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0052 0.0558 0.0658
Mycobacterium ulcerans acyl-CoA synthetase 0.0042 0.0425 0.492
Loa Loa (eye worm) hypothetical protein 0.0023 0.0167 0.0353
Plasmodium falciparum pyruvate kinase 2 0.0016 0.0059 0.1671
Brugia malayi Intermediate filament tail domain containing protein 0.0023 0.0167 0.0313
Loa Loa (eye worm) hypothetical protein 0.0026 0.0197 0.0416
Trichomonas vaginalis tubulin, putative 0.0014 0.0042 0.1101
Schistosoma mansoni intermediate filament proteins 0.0023 0.0167 0.018
Schistosoma mansoni tubulin subunit beta 0.0014 0.0042 0.0032
Entamoeba histolytica acyl-CoA synthetase, putative 0.0042 0.0425 1
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0026 0.0197 0.7361
Trypanosoma cruzi STE/STE11 serine/threonine-protein kinase, putative 0.0026 0.0197 0.7361
Brugia malayi bZIP transcription factor family protein 0.0364 0.4868 1
Entamoeba histolytica tubulin family protein 0.0014 0.0042 0.0664
Echinococcus multilocularis aryl hydrocarbon receptor 0.0026 0.0197 0.0197
Loa Loa (eye worm) aryl Hydrocarbon receptor Associated protein family member 0.0026 0.0197 0.0416
Onchocerca volvulus 0.0023 0.0167 0.0403
Trypanosoma brucei beta tubulin 0.0014 0.0042 0.1101
Echinococcus granulosus pyruvate kinase 0.003 0.0262 0.0309
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0026 0.0197 0.7361
Brugia malayi RNA binding protein 0.0055 0.0602 0.121
Onchocerca volvulus Pyruvate kinase homolog 0.003 0.0262 0.0655
Entamoeba histolytica acyl-CoA synthetase, putative 0.0042 0.0425 1
Brugia malayi PAS domain containing protein 0.0098 0.1201 0.2443
Echinococcus granulosus tumor protein p63 0.0307 0.4076 0.4803
Trypanosoma cruzi ISWI complex protein 0.0013 0.0027 0.0507
Plasmodium falciparum acyl-CoA synthetase 0.0031 0.0278 1
Schistosoma mansoni hypothetical protein 0.006 0.0679 0.0784
Trypanosoma brucei pyruvate kinase 1 0.003 0.0262 1
Brugia malayi AMP-binding enzyme family protein 0.0042 0.0425 0.0845
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0031 0.0278 0.3159
Echinococcus granulosus zinc finger protein 0.0017 0.0078 0.0092
Leishmania major beta tubulin 0.0014 0.0042 0.0664
Echinococcus granulosus Aryl hydrocarbon receptor nuclear 0.0026 0.0197 0.0232
Loa Loa (eye worm) hypothetical protein 0.0045 0.0464 0.098
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0026 0.0197 0.7361
Brugia malayi RNA recognition motif domain containing protein 0.0055 0.0602 0.121
Brugia malayi hypoxia-induced factor 1 0.0304 0.4042 0.8298
Trypanosoma cruzi STE group serine/threonine-protein kinase, putative 0.0026 0.0197 0.7361
Leishmania major beta tubulin 0.0014 0.0042 0.0664
Leishmania major protein kinase, putative 0.0026 0.0197 0.444
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0028 0.0231 0.0231
Leishmania major beta tubulin 0.0014 0.0042 0.0664
Leishmania major beta tubulin 0.0014 0.0042 0.0664
Onchocerca volvulus 0.0017 0.0075 0.016
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.003 0.0254 0.5844
Trichomonas vaginalis pyruvate kinase, putative 0.003 0.0262 1
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0023 0.0167 0.0353
Loa Loa (eye worm) hypothetical protein 0.0021 0.0136 0.0287
Loa Loa (eye worm) tubulin beta-1 chain 0.0014 0.0042 0.0089
Brugia malayi Bromodomain containing protein 0.0065 0.0741 0.1497
Loa Loa (eye worm) hypothetical protein 0.0017 0.0075 0.0159
Loa Loa (eye worm) pyruvate kinase 0.003 0.0262 0.0554
Trypanosoma cruzi PAS-domain containing phosphoglycerate kinase, putative 0.0026 0.0197 0.7361
Onchocerca volvulus 0.0073 0.0848 0.2208
Echinococcus multilocularis lamin 0.0023 0.0167 0.0167
Echinococcus multilocularis GPCR, family 2 0.0028 0.0231 0.0231
Trichomonas vaginalis tubulin beta chain, putative 0.0014 0.0042 0.1101
Leishmania major beta tubulin 0.0014 0.0042 0.0664
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0055 0.0602 0.1273
Echinococcus multilocularis pyruvate kinase 0.0016 0.0059 0.0059
Trypanosoma brucei ISWI complex protein 0.0013 0.0027 0.0507
Echinococcus granulosus tubulin subunit beta 0.0014 0.0042 0.0049
Schistosoma mansoni jun-related protein 0.0296 0.3927 0.4618
Echinococcus granulosus jun protein 0.0364 0.4868 0.5736
Mycobacterium ulcerans acyl-CoA synthetase 0.0042 0.0425 0.492
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0031 0.0274 0.0323
Leishmania major beta tubulin 0.0014 0.0042 0.0664
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0088 0.1065 0.2251
Schistosoma mansoni pyruvate kinase 0.0016 0.0059 0.0052
Mycobacterium leprae Possible regulatory protein 0.0026 0.0197 0.444
Brugia malayi TAR-binding protein 0.0055 0.0602 0.121
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0013 0.0017 0.0036
Giardia lamblia Pyruvate kinase 0.0016 0.0059 0.0762
Schistosoma mansoni cellular tumor antigen P53 0.0045 0.0464 0.053
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0015 0.0048 0.0048
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0015 0.0048 0.004
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0052 0.0558 0.0558
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0042 0.0425 1
Echinococcus granulosus tar DNA binding protein 0.0055 0.0602 0.0709
Schistosoma mansoni methyl-cpg binding protein mbd 0.0015 0.0048 0.004
Schistosoma mansoni hypothetical protein 0.0296 0.3927 0.4618
Echinococcus multilocularis jun protein 0.0364 0.4868 0.4868
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0042 0.0425 0.492
Echinococcus granulosus methyl CpG binding domain protein 2 0.0015 0.0048 0.0057
Trypanosoma cruzi ISWI complex protein 0.0013 0.0027 0.0507
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0028 0.0231 0.0272
Brugia malayi hypothetical protein 0.0017 0.0075 0.0125
Echinococcus multilocularis Tubulin beta 2C chain 0.0014 0.0042 0.0042
Plasmodium vivax pyruvate kinase, putative 0.003 0.0262 0.9393
Leishmania major beta tubulin 0.0014 0.0042 0.0664
Leishmania major beta tubulin 0.0014 0.0042 0.0664
Leishmania major beta tubulin 0.0014 0.0042 0.0664
Loa Loa (eye worm) hypothetical protein 0.0012 0.0015 0.0031
Schistosoma mansoni tubulin subunit beta 0.0014 0.0042 0.0032
Trypanosoma brucei pyruvate kinase 1, putative 0.003 0.0262 1
Echinococcus multilocularis transfer RNA-Lys 0.0073 0.0848 0.0848
Loa Loa (eye worm) hypothetical protein 0.0042 0.0425 0.0898
Brugia malayi PHD-finger family protein 0.0022 0.0142 0.0263
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.002 0.0114 0.0117
Loa Loa (eye worm) BEN-1 protein 0.0014 0.0042 0.0089
Leishmania major beta tubulin 0.0014 0.0042 0.0664
Schistosoma mansoni tubulin subunit beta 0.0014 0.0042 0.0032
Echinococcus multilocularis pyruvate kinase 0.0016 0.0059 0.0059
Onchocerca volvulus 0.0026 0.0197 0.0482
Echinococcus granulosus single minded 2 0.0073 0.0848 0.0999
Echinococcus multilocularis tubulin beta 1 chain 0.0014 0.0042 0.0042
Schistosoma mansoni pyruvate kinase 0.003 0.0262 0.0292
Brugia malayi intermediate filament protein 0.0023 0.0167 0.0313
Toxoplasma gondii beta tubulin 0.0014 0.0042 0.1101
Onchocerca volvulus 0.0286 0.3789 1
Loa Loa (eye worm) hypothetical protein 0.003 0.0262 0.0554
Echinococcus multilocularis Aryl hydrocarbon receptor nuclear 0.0026 0.0197 0.0197
Brugia malayi beta-tubulin, identical 0.0014 0.0042 0.0056
Loa Loa (eye worm) hypothetical protein 0.0033 0.0303 0.0641
Brugia malayi Bromodomain containing protein 0.0033 0.0302 0.0593
Echinococcus granulosus beta tubulin 0.0014 0.0042 0.0049
Echinococcus multilocularis lamin dm0 0.0023 0.0167 0.0167
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.003 0.0254 0.5844
Loa Loa (eye worm) PHD-finger family protein 0.0018 0.0091 0.0193
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0042 0.0425 0.492
Leishmania major beta tubulin 0.0014 0.0042 0.0664
Echinococcus multilocularis fetal alzheimer antigen, falz 0.002 0.0114 0.0114
Echinococcus granulosus MAM 0.0017 0.0075 0.0089
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription factor 0.0364 0.4868 0.4868
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0088 0.1065 0.2164
Loa Loa (eye worm) hypothetical protein 0.0031 0.0278 0.0588
Schistosoma mansoni hypothetical protein 0.0017 0.0075 0.0071
Echinococcus granulosus pyruvate kinase 0.0016 0.0059 0.0069
Plasmodium vivax acyl-CoA synthetase, putative 0.0031 0.0278 1
Toxoplasma gondii beta-1 tubulin, putative 0.0014 0.0042 0.1101
Loa Loa (eye worm) hypothetical protein 0.0061 0.069 0.1459
Loa Loa (eye worm) hypothetical protein 0.0023 0.0161 0.034
Echinococcus multilocularis Tubulin beta 2C chain 0.0014 0.0042 0.0042
Loa Loa (eye worm) hypothetical protein 0.0042 0.0425 0.0898
Mycobacterium ulcerans acyl-CoA synthetase 0.0042 0.0425 0.492
Echinococcus multilocularis MAM 0.0017 0.0075 0.0075
Toxoplasma gondii pyruvate kinase PyKII 0.0016 0.0059 0.1779
Mycobacterium ulcerans pyruvate kinase 0.003 0.0262 0.2968
Trichomonas vaginalis adenylate cyclase, type VII, putative 0.0026 0.0197 0.7361
Leishmania major PAS-domain containing phosphoglycerate kinase, putative 0.0026 0.0197 0.444
Schistosoma mansoni hypothetical protein 0.0028 0.0231 0.0255
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0031 0.0278 1
Loa Loa (eye worm) hypothetical protein 0.0031 0.0278 0.0588
Leishmania major beta tubulin 0.0014 0.0042 0.0664
Echinococcus granulosus Tubulin beta 2C chain 0.0014 0.0042 0.0049
Echinococcus granulosus pyruvate kinase 0.003 0.0262 0.0309
Echinococcus granulosus tubulin beta 4A class IVa 0.0014 0.0042 0.0049
Loa Loa (eye worm) pyruvate kinase-PB 0.0021 0.0136 0.0287
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0028 0.0231 0.0445
Trypanosoma cruzi pyruvate kinase 2, putative 0.003 0.0262 1
Loa Loa (eye worm) hypothetical protein 0.0088 0.1065 0.2251
Brugia malayi AMP-binding enzyme family protein 0.0042 0.0425 0.0845
Mycobacterium leprae Probable pyruvate kinase PykA 0.003 0.0262 0.6032
Schistosoma mansoni lamin 0.0023 0.0167 0.018
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0031 0.0278 0.6421
Giardia lamblia Pyruvate kinase 0.003 0.0262 1
Loa Loa (eye worm) TAR-binding protein 0.0055 0.0602 0.1273
Onchocerca volvulus Pyruvate kinase homolog 0.003 0.0262 0.0655
Loa Loa (eye worm) hypothetical protein 0.0017 0.0075 0.0159
Loa Loa (eye worm) hypothetical protein 0.0017 0.0075 0.0159
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0042 0.0425 0.492
Echinococcus granulosus tubulin beta 1 chain 0.0014 0.0042 0.0049
Loa Loa (eye worm) beta-tubulin 0.0014 0.0042 0.0089
Leishmania major beta tubulin 0.0014 0.0042 0.0664
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0028 0.0231 0.0272
Trichomonas vaginalis guanylate cyclase, putative 0.0026 0.0197 0.7361
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0015 0.0048 0.004
Echinococcus granulosus Tubulin beta 2C chain 0.0014 0.0042 0.0049
Brugia malayi Tubulin beta-1 chain 0.0014 0.0042 0.0056
Echinococcus granulosus Tubulin beta 2C chain 0.0014 0.0042 0.0049
Schistosoma mansoni hypothetical protein 0.0017 0.0075 0.0071
Brugia malayi Latrophilin receptor protein 2 0.0028 0.0231 0.0445
Echinococcus granulosus GPCR family 2 0.0028 0.0231 0.0272
Echinococcus granulosus Basic leucine zipper bZIP transcription factor 0.0364 0.4868 0.5736
Trichomonas vaginalis conserved hypothetical protein 0.0026 0.0197 0.7361
Loa Loa (eye worm) hypothetical protein 0.033 0.4395 0.929
Onchocerca volvulus 0.0045 0.0464 0.1189
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0042 0.0425 0.492
Leishmania major beta tubulin 0.0014 0.0042 0.0664
Leishmania major 4-coumarate:coa ligase-like protein 0.0042 0.0425 1
Leishmania major beta tubulin 0.0014 0.0042 0.0664
Loa Loa (eye worm) latrophilin receptor protein 2 0.0028 0.0231 0.0487
Echinococcus granulosus acetyl coenzyme A synthetase cytoplasmic 0.0012 0.0015 0.0017
Loa Loa (eye worm) tubulin beta-2A chain 0.0014 0.0042 0.0089
Echinococcus multilocularis tubulin subunit beta 0.0014 0.0042 0.0042
Loa Loa (eye worm) pyruvate kinase 0.003 0.0262 0.0554
Leishmania major beta tubulin 0.0014 0.0042 0.0664
Echinococcus granulosus pyruvate kinase 0.0016 0.0059 0.0069
Brugia malayi Protein kinase domain containing protein 0.014 0.1782 0.3641
Loa Loa (eye worm) pyruvate kinase 0.003 0.0262 0.0554
Plasmodium falciparum tubulin beta chain 0.0014 0.0042 0.1034
Loa Loa (eye worm) oxidoreductase 0.0012 0.0015 0.0031
Schistosoma mansoni aryl hydrocarbon receptor 0.0098 0.1201 0.14
Trichomonas vaginalis conserved hypothetical protein 0.0026 0.0197 0.7361
Toxoplasma gondii pyruvate kinase PyK1 0.003 0.0262 1
Echinococcus multilocularis beta tubulin 0.0014 0.0042 0.0042
Mycobacterium tuberculosis Probable pyruvate kinase PykA 0.003 0.0262 0.6032
Schistosoma mansoni single-minded 0.0098 0.1201 0.14
Schistosoma mansoni tubulin subunit beta 0.0014 0.0042 0.0032
Mycobacterium ulcerans hypothetical protein 0.0042 0.0425 0.492
Echinococcus multilocularis tubulin, beta 4A class IVa 0.0014 0.0042 0.0042
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.003 0.0254 0.5844
Schistosoma mansoni hypothetical protein 0.0028 0.0231 0.0255
Echinococcus granulosus lamin 0.0023 0.0167 0.0197
Brugia malayi cytoplasmic intermediate filament protein 0.0013 0.0017 0.0005
Entamoeba histolytica acyl-coA synthetase, putative 0.0042 0.0425 1
Trypanosoma brucei beta tubulin 0.0014 0.0042 0.1101
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0042 0.0425 1
Trichomonas vaginalis tubulin alpha chain, putative 0.0014 0.0042 0.1101
Loa Loa (eye worm) hypothetical protein 0.0035 0.0332 0.0701
Schistosoma mansoni tar DNA-binding protein 0.0055 0.0602 0.0693
Loa Loa (eye worm) hypothetical protein 0.0012 0.0015 0.0031
Schistosoma mansoni pyruvate kinase 0.003 0.0262 0.0292
Onchocerca volvulus 0.0017 0.0075 0.016
Brugia malayi bHLH-PAS transcription factor 0.0073 0.0848 0.1717
Loa Loa (eye worm) hypothetical protein 0.0028 0.0231 0.0487
Schistosoma mansoni tar DNA-binding protein 0.0055 0.0602 0.0693
Loa Loa (eye worm) tubulin beta-4 chain 0.0014 0.0042 0.0089
Loa Loa (eye worm) tubulin beta chain 0.0014 0.0042 0.0089
Schistosoma mansoni bromodomain containing protein 0.0055 0.0601 0.0692
Loa Loa (eye worm) hypothetical protein 0.0037 0.0354 0.0749
Echinococcus multilocularis pyruvate kinase 0.003 0.0262 0.0262
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0042 0.0425 1
Trypanosoma brucei beta tubulin 0.0014 0.0042 0.1101

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) < 100 uM Concentration required to reduce binding of fibrinogen to purified Fibrinogen Receptor by 50% using ELISA ChEMBL. 9207949
IC50 (binding) < 100 uM Concentration required to reduce binding of fibrinogen to purified Fibrinogen Receptor by 50% using ELISA ChEMBL. 9207949

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.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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