Detailed information for compound 1343543

Basic information

Technical information
  • TDR Targets ID: 1343543
  • Name: 1,4-di(phenyl)-3H-imidazole-2-thione
  • MW: 252.334 | Formula: C15H12N2S
  • H donors: 0 H acceptors: 1 LogP: 3.82 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: Sc1nc(cn1c1ccccc1)c1ccccc1
  • InChi: 1S/C15H12N2S/c18-15-16-14(12-7-3-1-4-8-12)11-17(15)13-9-5-2-6-10-13/h1-11H,(H,16,18)
  • InChiKey: QKOAQVKXZJFMET-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • Oprea1_001855
  • Oprea1_390591
  • ChemDiv3_012382
  • EU-0027322
  • ZINC00160538

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Leishmania mexicana pyruvate kinase, putative Starlite/ChEMBL No references
Homo sapiens euchromatic histone-lysine N-methyltransferase 2 Starlite/ChEMBL No references
Mus musculus RAR-related orphan receptor gamma Starlite/ChEMBL No references
Homo sapiens RAB9A, member RAS oncogene family Starlite/ChEMBL No references
Trypanosoma brucei hypothetical protein, conserved Starlite/ChEMBL No references
Homo sapiens TAR DNA binding protein Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Loa Loa (eye worm) TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Onchocerca volvulus Pyruvate kinase homolog Get druggable targets OG5_126685 All targets in OG5_126685
Echinococcus granulosus pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Loa Loa (eye worm) pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Trypanosoma brucei gambiense pyruvate kinase 1, putative Get druggable targets OG5_126685 All targets in OG5_126685
Trichomonas vaginalis set domain proteins, putative Get druggable targets OG5_131470 All targets in OG5_131470
Schistosoma mansoni pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Schistosoma mansoni pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Trichomonas vaginalis pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Loa Loa (eye worm) pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Toxoplasma gondii pyruvate kinase PyK1 Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania major pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Trypanosoma brucei hypothetical protein, conserved Get druggable targets OG5_146801 All targets in OG5_146801
Cryptosporidium parvum pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Trypanosoma congolense HpcH/HpaI aldolase/citrate lyase family, putative Get druggable targets OG5_146801 All targets in OG5_146801
Giardia lamblia Pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Mycobacterium ulcerans pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania infantum pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Leishmania donovani HpcH/HpaI aldolase/citrate lyase family, putative Get druggable targets OG5_146801 All targets in OG5_146801
Trypanosoma congolense pyruvate kinase 1, putative Get druggable targets OG5_126685 All targets in OG5_126685
Trypanosoma cruzi pyruvate kinase 2, putative Get druggable targets OG5_126685 All targets in OG5_126685
Mycobacterium tuberculosis Probable pyruvate kinase PykA Get druggable targets OG5_126685 All targets in OG5_126685
Plasmodium knowlesi pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126685 All targets in OG5_126685
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Onchocerca volvulus Pyruvate kinase homolog Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania mexicana hypothetical protein, conserved Get druggable targets OG5_146801 All targets in OG5_146801
Leishmania major pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania mexicana pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Echinococcus granulosus pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Leishmania major hypothetical protein, conserved Get druggable targets OG5_146801 All targets in OG5_146801
Candida albicans pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Leishmania braziliensis pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Echinococcus multilocularis tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
Cryptosporidium hominis pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania braziliensis hypothetical protein, conserved Get druggable targets OG5_146801 All targets in OG5_146801
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Onchocerca volvulus Get druggable targets OG5_131470 All targets in OG5_131470
Echinococcus multilocularis pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Onchocerca volvulus Pyruvate kinase homolog Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania donovani pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Loa Loa (eye worm) RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) pre-SET domain-containing protein family protein Get druggable targets OG5_131470 All targets in OG5_131470
Plasmodium vivax pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Entamoeba histolytica pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Chlamydia trachomatis pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Brugia malayi Pyruvate kinase, muscle isozyme Get druggable targets OG5_126685 All targets in OG5_126685
Brugia malayi Pre-SET motif family protein Get druggable targets OG5_131470 All targets in OG5_131470
Candida albicans pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Brugia malayi RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Plasmodium yoelii pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Trypanosoma brucei pyruvate kinase 1, putative Get druggable targets OG5_126685 All targets in OG5_126685
Babesia bovis pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Trypanosoma cruzi pyruvate kinase 2, putative Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania braziliensis pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Brugia malayi RNA recognition motif domain containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus granulosus tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma japonicum Pyruvate kinase isozyme R, putative Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania braziliensis pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania mexicana pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Plasmodium berghei pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania infantum pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126685 All targets in OG5_126685
Brugia malayi Pyruvate kinase, M2 isozyme Get druggable targets OG5_126685 All targets in OG5_126685
Trypanosoma brucei pyruvate kinase 1 Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania infantum hypothetical protein, conserved Get druggable targets OG5_146801 All targets in OG5_146801
Trypanosoma brucei gambiense pyruvate kinase 1, putative Get druggable targets OG5_126685 All targets in OG5_126685
Plasmodium falciparum pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Trypanosoma cruzi hypothetical protein, conserved Get druggable targets OG5_146801 All targets in OG5_146801
Trypanosoma brucei gambiense hypothetical protein, conserved Get druggable targets OG5_146801 All targets in OG5_146801
Trypanosoma cruzi hypothetical protein, conserved Get druggable targets OG5_146801 All targets in OG5_146801
Trichomonas vaginalis pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Mycobacterium leprae Probable pyruvate kinase PykA Get druggable targets OG5_126685 All targets in OG5_126685
Echinococcus multilocularis pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Neospora caninum Pyruvate kinase (EC 2.7.1.40), related Get druggable targets OG5_126685 All targets in OG5_126685
Theileria parva pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Loa Loa (eye worm) pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma japonicum ko:K00873 pyruvate kinase [EC2.7.1.40], putative Get druggable targets OG5_126685 All targets in OG5_126685
Echinococcus multilocularis pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Loa Loa (eye worm) pyruvate kinase-PB Get druggable targets OG5_126685 All targets in OG5_126685
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Plasmodium falciparum ras-related protein Rab-5B RAB9A, member RAS oncogene family 201 aa 165 aa 30.9 %
Echinococcus granulosus pyruvate kinase pyruvate kinase, putative 498 aa 515 aa 27.6 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni cathepsin F (C01 family) 0.0057 0.141 0.2438
Toxoplasma gondii pyruvate kinase PyKII 0.0021 0.0059 0.0249
Loa Loa (eye worm) hypothetical protein 0.0026 0.0246 0.0283
Brugia malayi cathepsin L-like precursor 0.0057 0.141 0.1621
Plasmodium falciparum cysteine proteinase falcipain 1 0.0045 0.0961 0.4054
Trypanosoma brucei cysteine peptidase C (CPC) 0.0067 0.1789 0.1227
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0057 0.141 0.1583
Entamoeba histolytica cysteine protease, putative 0.0045 0.0961 0.4054
Entamoeba histolytica cysteine proteinase 2 0.0045 0.0961 0.4054
Entamoeba histolytica pyruvate kinase, putative 0.0028 0.0337 0.1421
Trypanosoma cruzi hypothetical protein, conserved 0.0257 0.8908 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0635 0.1098
Trichomonas vaginalis set domain proteins, putative 0.0286 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0082 0.2371 0.1945
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0082 0.2371 0.1945
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0635 0.1098
Onchocerca volvulus Cathepsin L homolog 0.0082 0.2371 0.2371
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0082 0.2371 0.2371
Onchocerca volvulus Pyruvate kinase homolog 0.004 0.0793 0.0793
Brugia malayi Cathepsin L-like precursor 0.0082 0.2371 0.2726
Loa Loa (eye worm) cathepsin B 0.0067 0.1789 0.2056
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0082 0.2371 0.2371
Onchocerca volvulus 0.0057 0.141 0.141
Brugia malayi Cathepsin L-like precursor 0.0057 0.141 0.1621
Echinococcus granulosus pyruvate kinase 0.004 0.0793 0.1372
Loa Loa (eye worm) hypothetical protein 0.0082 0.2371 0.2726
Schistosoma mansoni cathepsin F (C01 family) 0.0082 0.2371 0.41
Leishmania major cathepsin L-like protease 0.0082 0.2371 0.2324
Brugia malayi Pyruvate kinase, M2 isozyme 0.004 0.0793 0.0912
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0082 0.2371 0.1945
Onchocerca volvulus 0.0082 0.2371 0.2371
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0082 0.2371 0.1945
Echinococcus granulosus pyruvate kinase 0.004 0.0793 0.1372
Trypanosoma cruzi cysteine peptidase, putative 0.0082 0.2371 0.2662
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0082 0.2371 0.2371
Echinococcus multilocularis pyruvate kinase 0.0021 0.0059 0.0102
Entamoeba histolytica cysteine protease, putative 0.0045 0.0961 0.4054
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0082 0.2371 0.2371
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0082 0.2371 0.2371
Leishmania major cathepsin L-like protease 0.0082 0.2371 0.2324
Loa Loa (eye worm) hypothetical protein 0.0026 0.0246 0.0283
Loa Loa (eye worm) pyruvate kinase 0.004 0.0793 0.0912
Plasmodium vivax unspecified product 0.0045 0.0961 0.4054
Brugia malayi Cathepsin L-like precursor 0.0082 0.2371 0.2726
Schistosoma mansoni tar DNA-binding protein 0.0076 0.215 0.3717
Schistosoma mansoni tar DNA-binding protein 0.0076 0.215 0.3717
Loa Loa (eye worm) hypothetical protein 0.004 0.0793 0.0912
Loa Loa (eye worm) hypothetical protein 0.0028 0.0337 0.0387
Trypanosoma cruzi cruzipain precursor, putative 0.0082 0.2371 0.2662
Plasmodium falciparum cysteine proteinase falcipain 3 0.0082 0.2371 1
Echinococcus multilocularis pyruvate kinase 0.0032 0.0476 0.0822
Onchocerca volvulus 0.0082 0.2371 0.2371
Leishmania major cathepsin L-like protease 0.0082 0.2371 0.2324
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0082 0.2371 0.2371
Echinococcus granulosus cathepsin b 0.0174 0.5784 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0082 0.2371 0.2371
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0045 0.0961 0.1662
Giardia lamblia Pyruvate kinase 0.004 0.0793 0.4436
Giardia lamblia Cathepsin B precursor 0.0067 0.1789 1
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0067 0.1789 0.3093
Trypanosoma cruzi pyruvate kinase 2, putative 0.004 0.0793 0.0891
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0082 0.2371 0.2371
Loa Loa (eye worm) TAR-binding protein 0.0076 0.215 0.2472
Plasmodium vivax SET domain protein, putative 0.0036 0.0635 0.2677
Brugia malayi Pre-SET motif family protein 0.0036 0.0635 0.073
Loa Loa (eye worm) ctsf protein 0.0082 0.2371 0.2726
Entamoeba histolytica cysteine proteinase, putative 0.0045 0.0961 0.4054
Entamoeba histolytica cysteine protease, putative 0.0045 0.0961 0.4054
Brugia malayi Papain family cysteine protease containing protein 0.0045 0.0961 0.1105
Echinococcus multilocularis cathepsin b 0.0174 0.5784 1
Brugia malayi Cathepsin L-like precursor 0.0057 0.141 0.1621
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0082 0.2371 0.2726
Echinococcus multilocularis cathepsin b 0.0174 0.5784 1
Entamoeba histolytica cysteine protease, putative 0.0045 0.0961 0.4054
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0036 0.0635 0.1098
Brugia malayi cathepsin L-like cysteine proteinase, identical 0.0026 0.0246 0.0283
Entamoeba histolytica cysteine protease, putative 0.0045 0.0961 0.4054
Entamoeba histolytica cysteine proteinase 1, putative 0.0045 0.0961 0.4054
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0082 0.2371 0.2371
Trypanosoma cruzi 2,4-dihydroxyhept-2-ene-1,7-dioic acid aldolase, putative 0.003 0.0393 0.0441
Loa Loa (eye worm) hypothetical protein 0.0026 0.0246 0.0283
Loa Loa (eye worm) hypothetical protein 0.0057 0.141 0.1621
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0082 0.2371 0.1945
Toxoplasma gondii cathepsin CPL 0.0082 0.2371 1
Onchocerca volvulus 0.0036 0.0635 0.0635
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0076 0.215 0.2472
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0036 0.0635 0.1098
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0251 0.8699 1
Entamoeba histolytica cysteine protease, putative 0.0045 0.0961 0.4054
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0082 0.2371 0.2371
Giardia lamblia Cathepsin B precursor 0.0067 0.1789 1
Trypanosoma cruzi cysteine proteinase, putative 0.0045 0.0961 0.1079
Brugia malayi Pyruvate kinase, muscle isozyme 0.004 0.0793 0.0912
Brugia malayi Cathepsin L-like precursor 0.0082 0.2371 0.2726
Echinococcus granulosus cathepsin l1 0.0057 0.141 0.2438
Onchocerca volvulus 0.0082 0.2371 0.2371
Brugia malayi Pre-SET motif family protein 0.0251 0.8699 1
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0082 0.2371 0.41
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0082 0.2371 1
Plasmodium vivax vivapain-2 0.0082 0.2371 1
Loa Loa (eye worm) hypothetical protein 0.0174 0.5784 0.6649
Onchocerca volvulus Pyruvate kinase homolog 0.004 0.0793 0.0793
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0635 0.1098
Entamoeba histolytica cysteine proteinase, putative 0.0045 0.0961 0.4054
Loa Loa (eye worm) hypothetical protein 0.0057 0.141 0.1621
Plasmodium vivax pyruvate kinase 2, putative 0.0021 0.0059 0.0249
Echinococcus granulosus citrate lyase subunit beta protein 0.003 0.0393 0.0679
Onchocerca volvulus 0.0082 0.2371 0.2371
Plasmodium vivax vivapain-3 0.0045 0.0961 0.4054
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0082 0.2371 0.2371
Onchocerca volvulus 0.0082 0.2371 0.2371
Schistosoma mansoni cathepsin s 0.0026 0.0246 0.0425
Leishmania major cathepsin L-like protease 0.0082 0.2371 0.2324
Loa Loa (eye worm) pyruvate kinase-PB 0.0028 0.0337 0.0387
Trichomonas vaginalis Citrate lyase beta chain, putative 0.003 0.0393 0.0393
Leishmania major cysteine peptidase A (CPA) 0.0082 0.2371 0.2324
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0036 0.0635 0.1098
Entamoeba histolytica cysteine proteinase, putative 0.0045 0.0961 0.4054
Echinococcus multilocularis cysteine protease 0.0082 0.2371 0.41
Toxoplasma gondii pyruvate kinase PyK1 0.004 0.0793 0.3346
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0082 0.2371 0.1945
Echinococcus multilocularis cysteine protease 0.0082 0.2371 0.41
Giardia lamblia Cathepsin B precursor 0.0067 0.1789 1
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0045 0.0961 0.1662
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0082 0.2371 0.2371
Schistosoma mansoni pyruvate kinase 0.0021 0.0059 0.0102
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0082 0.2371 0.2371
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0082 0.2371 0.1945
Chlamydia trachomatis pyruvate kinase 0.004 0.0793 0.5
Entamoeba histolytica cysteine protease, putative 0.0045 0.0961 0.4054
Schistosoma mansoni SmCB2 peptidase (C01 family) 0.0174 0.5784 1
Echinococcus multilocularis cathepsin L cysteine protease 0.0082 0.2371 0.41
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0174 0.5784 1
Trypanosoma cruzi cysteine peptidase, putative 0.0082 0.2371 0.2662
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0082 0.2371 0.2371
Schistosoma mansoni pyruvate kinase 0.004 0.0793 0.1372
Onchocerca volvulus 0.0082 0.2371 0.2371
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0082 0.2371 0.1945
Echinococcus multilocularis citrate lyase subunit beta protein 0.003 0.0393 0.0679
Echinococcus multilocularis pyruvate kinase 0.0021 0.0059 0.0102
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0082 0.2371 0.2371
Entamoeba histolytica cysteine protease, putative 0.0045 0.0961 0.4054
Loa Loa (eye worm) fibroinase 0.0082 0.2371 0.2726
Echinococcus granulosus cathepsin l cysteine peptidase 0.0082 0.2371 0.41
Brugia malayi cathepsin F-like cysteine proteinase 0.0026 0.0246 0.0283
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0045 0.0961 0.1662
Loa Loa (eye worm) RNA binding protein 0.0076 0.215 0.2472
Trichomonas vaginalis pyruvate kinase, putative 0.004 0.0793 0.0793
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.0174 0.5784 0.6493
Trypanosoma cruzi cysteine protease, putative 0.0045 0.0961 0.1079
Toxoplasma gondii cathepsin B 0.0067 0.1789 0.7543
Onchocerca volvulus Cathepsin F homolog 0.0082 0.2371 0.2371
Trypanosoma cruzi hypothetical protein, conserved 0.0257 0.8908 1
Leishmania major hypothetical protein, conserved 0.0257 0.8908 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0057 0.141 0.141
Plasmodium falciparum pyruvate kinase 2 0.0021 0.0059 0.0249
Onchocerca volvulus 0.0082 0.2371 0.2371
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0082 0.2371 0.2371
Plasmodium vivax vivapain-2 0.0082 0.2371 1
Brugia malayi Cathepsin L-like precursor 0.0082 0.2371 0.2726
Brugia malayi Cathepsin L-like precursor 0.0082 0.2371 0.2726
Entamoeba histolytica cysteine protease, putative 0.0082 0.2371 1
Echinococcus granulosus cysteine protease 0.0045 0.0961 0.1662
Echinococcus multilocularis tar DNA binding protein 0.0076 0.215 0.3717
Brugia malayi RNA recognition motif domain containing protein 0.0076 0.215 0.2472
Trichomonas vaginalis pyruvate kinase, putative 0.004 0.0793 0.0793
Echinococcus granulosus cathepsin b 0.0174 0.5784 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0082 0.2371 0.2371
Leishmania major pyruvate kinase 0.004 0.0793 0.0471
Loa Loa (eye worm) hypothetical protein 0.0036 0.0635 0.073
Loa Loa (eye worm) hypothetical protein 0.0057 0.141 0.1621
Mycobacterium leprae Probable pyruvate kinase PykA 0.004 0.0793 0.5
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0082 0.2371 0.1945
Echinococcus granulosus pyruvate kinase 0.0021 0.0059 0.0102
Loa Loa (eye worm) cysteine protease 0.0082 0.2371 0.2726
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0082 0.2371 0.2371
Plasmodium vivax vivapain-1 0.0045 0.0961 0.4054
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0045 0.0961 0.0207
Entamoeba histolytica cysteine protease, putative 0.0045 0.0961 0.4054
Echinococcus granulosus cathepsin L cysteine protease 0.0045 0.0961 0.1662
Echinococcus granulosus cathepsin l1 0.0082 0.2371 0.41
Entamoeba histolytica cysteine protease, putative 0.0045 0.0961 0.4054
Trypanosoma cruzi cysteine peptidase, putative 0.0082 0.2371 0.2662
Echinococcus granulosus cathepsin L cysteine proteinase 0.0082 0.2371 0.41
Schistosoma mansoni tar DNA-binding protein 0.0076 0.215 0.3717
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0082 0.2371 0.1945
Echinococcus multilocularis cathepsin L 0.0045 0.0961 0.1662
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0045 0.0961 0.0961
Brugia malayi Cathepsin L-like precursor 0.0082 0.2371 0.2726
Leishmania major pyruvate kinase 0.004 0.0793 0.0471
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.0067 0.1789 0.2008
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0082 0.2371 0.2726
Brugia malayi TAR-binding protein 0.0076 0.215 0.2472
Trypanosoma cruzi pyruvate kinase 2, putative 0.004 0.0793 0.0891
Trypanosoma cruzi 2,4-dihydroxyhept-2-ene-1,7-dioic acid aldolase, putative 0.003 0.0393 0.0441
Entamoeba histolytica cysteine proteinase, putative 0.0082 0.2371 1
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0026 0.0246 0.0283
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0082 0.2371 0.2371
Leishmania major cathepsin L-like protease 0.0082 0.2371 0.2324
Leishmania major cathepsin L-like protease 0.0082 0.2371 0.2324
Echinococcus multilocularis pyruvate kinase 0.0021 0.0059 0.0102
Entamoeba histolytica cysteine proteinase, putative 0.0045 0.0961 0.4054
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0035 0.0585 0.1012
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0082 0.2371 0.2371
Echinococcus granulosus histone lysine methyltransferase setb 0.0036 0.0635 0.1098
Brugia malayi RNA binding protein 0.0076 0.215 0.2472
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0174 0.5784 1
Plasmodium falciparum pyruvate kinase 0.004 0.0793 0.3346
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0082 0.2371 0.2371
Echinococcus multilocularis pyruvate kinase 0.004 0.0793 0.1372
Mycobacterium tuberculosis Probable pyruvate kinase PykA 0.004 0.0793 1
Trypanosoma cruzi cruzipain precursor, putative 0.0026 0.0246 0.0276
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0045 0.0961 0.0961
Trypanosoma brucei hypothetical protein, conserved 0.0257 0.8908 1
Trypanosoma cruzi cysteine peptidase, putative 0.0082 0.2371 0.2662
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0045 0.0961 0.0207
Brugia malayi Cathepsin L-like precursor 0.0026 0.0246 0.0283
Brugia malayi Papain family cysteine protease containing protein 0.0082 0.2371 0.2726
Echinococcus granulosus pyruvate kinase 0.0021 0.0059 0.0102
Loa Loa (eye worm) pyruvate kinase 0.004 0.0793 0.0912
Plasmodium vivax unspecified product 0.0026 0.0246 0.1037
Echinococcus multilocularis pyruvate kinase 0.004 0.0793 0.1372
Entamoeba histolytica cysteine proteinase, putative 0.0082 0.2371 1
Brugia malayi Cathepsin L-like cysteine proteinase 0.0057 0.141 0.1621
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0082 0.2371 0.41
Onchocerca volvulus Cathepsin L homolog 0.0082 0.2371 0.2371
Loa Loa (eye worm) pyruvate kinase 0.004 0.0793 0.0912
Echinococcus multilocularis cathepsin L cysteine protease 0.0082 0.2371 0.41
Onchocerca volvulus Pyruvate kinase homolog 0.004 0.0793 0.0793
Giardia lamblia Pyruvate kinase 0.0021 0.0059 0.033
Schistosoma mansoni cathepsin F (C01 family) 0.0082 0.2371 0.41
Echinococcus granulosus cathepsin L 0.0045 0.0961 0.1662
Echinococcus granulosus tar DNA binding protein 0.0076 0.215 0.3717
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0082 0.2371 1
Leishmania major cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like 0.0067 0.1789 0.164
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0036 0.0635 0.2677
Entamoeba histolytica cysteine proteinase, putative 0.0057 0.141 0.5946
Brugia malayi cathepsin B-like cysteine proteinase 0.0174 0.5784 0.6649
Brugia malayi Papain family cysteine protease containing protein 0.0045 0.0961 0.1105
Schistosoma mansoni tar DNA-binding protein 0.0076 0.215 0.3717
Trypanosoma cruzi cysteine peptidase, putative 0.0045 0.0961 0.1079
Entamoeba histolytica cysteine protease, putative 0.0045 0.0961 0.4054
Schistosoma mansoni pyruvate kinase 0.004 0.0793 0.1372
Entamoeba histolytica cysteine protease, putative 0.0045 0.0961 0.4054
Entamoeba histolytica cysteine protease, putative 0.0045 0.0961 0.4054
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0057 0.141 0.141
Trypanosoma cruzi cysteine proteinase, putative 0.0045 0.0961 0.1079
Mycobacterium ulcerans pyruvate kinase 0.004 0.0793 1
Leishmania major cathepsin L-like protease 0.0082 0.2371 0.2324
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0082 0.2371 0.1945
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0082 0.2371 0.2371
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0082 0.2371 0.2371
Schistosoma mansoni tar DNA-binding protein 0.0076 0.215 0.3717
Leishmania major cathepsin L-like protease 0.0082 0.2371 0.2324
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0174 0.5784 1
Trypanosoma cruzi cysteine peptidase, putative 0.0026 0.0246 0.0276
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0082 0.2371 0.2371
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.0067 0.1789 0.1789
Trypanosoma cruzi cysteine peptidase (N-terminal), putative 0.0045 0.0961 0.1079
Echinococcus granulosus pyruvate kinase 0.0021 0.0059 0.0102
Plasmodium vivax pyruvate kinase, putative 0.004 0.0793 0.3346
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0082 0.2371 0.2371

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 0.5623 um PUBCHEM_BIOASSAY: qHTS Assay for Small Molecule Inhibitors of Mitochondrial Division or Activators of Mitochondrial Fusion. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 0.7079 um PUBCHEM_BIOASSAY: qHTS Assay for Rab9 Promoter Activators. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 2.5119 uM PubChem BioAssay. qHTS of Trypanosoma Brucei Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 9.285 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) = 10 um PUBCHEM_BIOASSAY: VP16 counterscreen qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 10 um PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 10 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference
Potency (functional) 12.5893 uM PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 15.8489 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Leishmania Mexicana Pyruvate Kinase (LmPK). (Class of assay: confirmatory) [Related pubchem assays: 1379 ] ChEMBL. No reference
Potency (functional) = 15.8489 um PUBCHEM_BIOASSAY: qHTS Assay for Activators of Leishmania Mexicana Pyruvate Kinase (LmPK). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 20.5878 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125] ChEMBL. No reference
Potency (functional) 25.1189 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402] ChEMBL. No reference
Potency (functional) = 31.6228 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Bacillus subtilis Sfp phosphopantetheinyl transferase (PPTase). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 44.6684 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] ChEMBL. No reference
Potency (functional) 44.6684 uM PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23
Saccharomyces cerevisiae ChEMBL23

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

No literature references available for this target.

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