Detailed information for compound 1220108

Basic information

Technical information
  • TDR Targets ID: 1220108
  • Name: methyl (4S)-4-(4-bromophenyl)-1-(cyclopropylm ethyl)-6-methyl-2-oxo-3,4-dihydropyrimidine-5 -carboxylate
  • MW: 379.248 | Formula: C17H19BrN2O3
  • H donors: 1 H acceptors: 2 LogP: 2.63 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: COC(=O)C1=C(C)N(C(=O)N[C@H]1c1ccc(cc1)Br)CC1CC1
  • InChi: 1S/C17H19BrN2O3/c1-10-14(16(21)23-2)15(12-5-7-13(18)8-6-12)19-17(22)20(10)9-11-3-4-11/h5-8,11,15H,3-4,9H2,1-2H3,(H,19,22)/t15-/m0/s1
  • InChiKey: MIAXAKPUEPKLPU-HNNXBMFYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • (4S)-4-(4-bromophenyl)-1-(cyclopropylmethyl)-6-methyl-2-oxo-3,4-dihydropyrimidine-5-carboxylic acid methyl ester
  • (4S)-4-(4-bromophenyl)-1-(cyclopropylmethyl)-2-keto-6-methyl-3,4-dihydropyrimidine-5-carboxylic acid methyl ester
  • CMLDBU00003844
  • MLS000438766
  • SMR000113221

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
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
Schistosoma mansoni tar DNA-binding protein 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
Brugia malayi RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi RNA recognition motif domain containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) TAR-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
Loa Loa (eye worm) RNA binding 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
Schistosoma mansoni tar DNA-binding protein 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
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 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
Echinococcus granulosus tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
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
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
Entamoeba histolytica cysteine protease, putative 0.0044 0.1095 0.3767
Trypanosoma cruzi cysteine peptidase, putative 0.0082 0.2349 0.516
Toxoplasma gondii cathepsin CPC1 0.0018 0.0239 0.0953
Onchocerca volvulus Histone deacetylase 10 homolog 0.0025 0.045 0.1917
Trypanosoma cruzi histone deacetylase, putative 0.0025 0.045 0.0989
Brugia malayi cahepsin L-like non-peptiedase homolog 0.0018 0.0239 0.0315
Plasmodium falciparum serine repeat antigen 2 0.0018 0.0239 0.0953
Echinococcus granulosus GTP binding nuclear protein Ran 0.0021 0.0343 0.0343
Schistosoma mansoni growth factor receptor-bound protein 0.0135 0.4127 0.4127
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0082 0.2349 0.9258
Trypanosoma brucei histone deacetylase 1 0.0087 0.251 1
Loa Loa (eye worm) hypothetical protein 0.0087 0.251 0.251
Toxoplasma gondii HEAT repeat-containing protein 0.0029 0.06 0.239
Loa Loa (eye worm) transcription factor SMAD2 0.0126 0.382 0.382
Echinococcus granulosus histone deacetylase 7 0.0025 0.045 0.045
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0082 0.2349 0.9258
Entamoeba histolytica cysteine proteinase, putative 0.0082 0.2349 0.9292
Toxoplasma gondii cathepsin CPC2 0.0018 0.0239 0.0953
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0148 0.4553 0.4553
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0082 0.2349 0.9292
Echinococcus multilocularis cathepsin L 0.0044 0.1095 0.1095
Brugia malayi Papain family cysteine protease containing protein 0.0018 0.0239 0.0315
Schistosoma mansoni subfamily C1A unassigned peptidase (C01 family) 0.0018 0.0239 0.0239
Plasmodium vivax vivapain-2 0.0082 0.2349 0.9359
Brugia malayi cathepsin Z-like cysteine proteinase 0.0018 0.0239 0.0315
Plasmodium vivax serine-repeat antigen 4 (SERA) 0.0018 0.0239 0.0953
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0082 0.2349 0.2349
Onchocerca volvulus 0.0082 0.2349 1
Plasmodium vivax serine-repeat antigen 2 (SERA) 0.0018 0.0239 0.0953
Plasmodium vivax dipeptidyl aminopeptidase 2, putative 0.0018 0.0239 0.0953
Echinococcus granulosus cathepsin L 0.0044 0.1095 0.1095
Brugia malayi Cathepsin L-like precursor 0.0056 0.1494 0.1967
Loa Loa (eye worm) histone deacetylase 0.0025 0.045 0.045
Entamoeba histolytica cysteine proteinase, putative 0.0056 0.1494 0.5525
Schistosoma mansoni dipeptidyl-peptidase I (C01 family) 0.0018 0.0239 0.0239
Loa Loa (eye worm) TAR-binding protein 0.0076 0.2175 0.2175
Loa Loa (eye worm) ctsf protein 0.0082 0.2349 0.2349
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0021 0.0343 0.1368
Plasmodium vivax histone deacetylase, putative 0.0025 0.045 0.1794
Giardia lamblia Cathepsin B precursor 0.0058 0.1573 0.5875
Brugia malayi Cathepsin L-like precursor 0.0082 0.2349 0.3093
Brugia malayi Papain family cysteine protease containing protein 0.0044 0.1095 0.1441
Leishmania major cathepsin L-like protease 0.0082 0.2349 0.9359
Onchocerca volvulus 0.0082 0.2349 1
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0082 0.2349 0.2349
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0148 0.4553 0.4553
Toxoplasma gondii preprocathepsin c precursor, putative 0.0018 0.0239 0.0953
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0082 0.2349 0.9258
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0021 0.0343 0.1368
Brugia malayi Cathepsin L-like cysteine proteinase 0.0056 0.1494 0.1967
Plasmodium vivax serine-repeat antigen (SERA) 0.0018 0.0239 0.0953
Echinococcus granulosus cathepsin L cysteine protease 0.0044 0.1095 0.1095
Brugia malayi Histone deacetylase family protein 0.0025 0.045 0.0593
Loa Loa (eye worm) hypothetical protein 0.0025 0.045 0.045
Trypanosoma cruzi histone deacetylase 1, putative 0.0087 0.251 0.5513
Loa Loa (eye worm) histone deacetylase 7A 0.0025 0.045 0.045
Echinococcus multilocularis histone deacetylase 7 0.0025 0.045 0.045
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0026 0.0484 0.0484
Brugia malayi histone deacetylase 1 (HD1) 0.0087 0.251 0.3304
Leishmania major cysteine peptidase A (CPA) 0.0082 0.2349 0.9359
Schistosoma mansoni cathepsin S (C01 family) 0.0018 0.0239 0.0239
Trypanosoma cruzi importin beta-1 subunit, putative 0.0024 0.0416 0.0914
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0018 0.0239 0.0239
Onchocerca volvulus Cathepsin F homolog 0.0082 0.2349 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0082 0.2349 0.9292
Echinococcus multilocularis cysteine protease 0.0082 0.2349 0.2349
Entamoeba histolytica cysteine protease, putative 0.0044 0.1095 0.3767
Brugia malayi cathepsin F-like cysteine proteinase 0.0018 0.0239 0.0315
Trypanosoma cruzi cysteine peptidase, putative 0.0026 0.0484 0.1062
Entamoeba histolytica cysteine proteinase 2 0.0044 0.1095 0.3767
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0021 0.0343 0.0754
Trypanosoma brucei histone deacetylase 4 0.0025 0.045 0.0494
Entamoeba histolytica cysteine protease, putative 0.0044 0.1095 0.3767
Trypanosoma brucei histone deacetylase 3 0.0025 0.045 0.0494
Plasmodium vivax serine-repeat antigen 4 (SERA), putative 0.0018 0.0239 0.0953
Echinococcus multilocularis histone deacetylase 1 0.0087 0.251 0.251
Brugia malayi cathepsin L-like cysteine proteinase, identical 0.0026 0.0484 0.0637
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0021 0.0343 0.0343
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0082 0.2349 0.9292
Plasmodium falciparum serine repeat antigen 7 0.0018 0.0239 0.0953
Schistosoma mansoni cathepsin C 0.0018 0.0239 0.0239
Schistosoma mansoni tar DNA-binding protein 0.0076 0.2175 0.2175
Trypanosoma cruzi major cysteine proteinase, putative 0.0018 0.0239 0.0526
Onchocerca volvulus 0.0018 0.0239 0.1019
Brugia malayi cathepsin L-like cysteine proteinase 0.0018 0.0239 0.0315
Loa Loa (eye worm) hypothetical protein 0.0239 0.7596 0.7596
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0056 0.1494 0.5525
Schistosoma mansoni survival motor neuron protein 0.0049 0.1254 0.1254
Loa Loa (eye worm) hypothetical protein 0.0018 0.0239 0.0239
Schistosoma mansoni tar DNA-binding protein 0.0076 0.2175 0.2175
Loa Loa (eye worm) hypothetical protein 0.0026 0.0484 0.0484
Plasmodium vivax serine-repeat antigen (SERA) 0.0018 0.0239 0.0953
Plasmodium falciparum serine repeat antigen 1 0.0018 0.0239 0.0953
Echinococcus multilocularis cathepsin b 0.0148 0.4553 0.4553
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0049 0.1254 0.165
Echinococcus multilocularis histone deacetylase 3 0.0087 0.251 0.251
Loa Loa (eye worm) fibroinase 0.0082 0.2349 0.2349
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0044 0.1095 0.3467
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0021 0.0343 0.0343
Plasmodium vivax unspecified product 0.0018 0.0239 0.0953
Trichomonas vaginalis histone deacetylase, putative 0.0087 0.251 1
Schistosoma mansoni histone deacetylase hda2 0.0025 0.045 0.045
Toxoplasma gondii cathepsin B 0.0058 0.1573 0.6269
Trypanosoma cruzi cysteine peptidase (N-terminal), putative 0.0044 0.1095 0.2404
Brugia malayi Cathepsin L-like precursor 0.0082 0.2349 0.3093
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.0087 0.251 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0082 0.2349 0.9292
Trypanosoma cruzi histone deacetylase, putative 0.0025 0.045 0.0989
Schistosoma mansoni cathepsin B (C01 family) 0.0018 0.0239 0.0239
Echinococcus multilocularis importin subunit beta 1 0.0029 0.06 0.06
Plasmodium falciparum dipeptidyl aminopeptidase 2 0.0018 0.0239 0.0953
Trypanosoma cruzi histone deacetylase, putative 0.0025 0.045 0.0989
Plasmodium vivax dipeptidyl aminopeptidase 1, putative 0.0018 0.0239 0.0953
Schistosoma mansoni importin beta-1 0.0029 0.06 0.06
Plasmodium falciparum dipeptidyl aminopeptidase 3 0.0018 0.0239 0.0953
Brugia malayi Histone deacetylase 1 0.0087 0.251 0.3304
Brugia malayi MH2 domain containing protein 0.0126 0.382 0.5029
Leishmania major cathepsin L-like protease 0.0082 0.2349 0.9359
Brugia malayi Papain family cysteine protease containing protein 0.0018 0.0239 0.0315
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0044 0.1095 0.3467
Leishmania major GTP-binding protein, putative 0.0021 0.0343 0.1368
Plasmodium falciparum serine repeat antigen 3 0.0018 0.0239 0.0953
Leishmania major importin beta-1 subunit, putative 0.0024 0.0416 0.1658
Onchocerca volvulus 0.0082 0.2349 1
Brugia malayi fibroinase precursor 0.0018 0.0239 0.0315
Schistosoma mansoni tar DNA-binding protein 0.0076 0.2175 0.2175
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0082 0.2349 0.9258
Entamoeba histolytica cysteine protease, putative 0.0044 0.1095 0.3767
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0021 0.0343 0.0754
Trypanosoma cruzi cysteine peptidase, putative 0.0082 0.2349 0.516
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0021 0.0343 0.0459
Schistosoma mansoni tar DNA-binding protein 0.0076 0.2175 0.2175
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0082 0.2349 0.9292
Echinococcus granulosus cathepsin l1 0.0056 0.1494 0.1494
Brugia malayi Cathepsin L-like precursor 0.0082 0.2349 0.3093
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0056 0.1494 0.5525
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.0087 0.251 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0082 0.2349 0.9292
Brugia malayi histone deacetylase 11 0.0025 0.045 0.0593
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0018 0.0239 0.0239
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0021 0.0343 0.0452
Brugia malayi TAR-binding protein 0.0076 0.2175 0.2863
Echinococcus granulosus histone deacetylase 6 0.0025 0.045 0.045
Brugia malayi histone deacetylase 3 (HD3) 0.0087 0.251 0.3304
Schistosoma mansoni subfamily C1A non-peptidase homologue (C01 family) 0.0018 0.0239 0.0239
Giardia lamblia Cathepsin B precursor 0.0058 0.1573 0.5875
Echinococcus granulosus tar DNA binding protein 0.0076 0.2175 0.2175
Plasmodium falciparum cysteine proteinase falcipain 3 0.0082 0.2349 0.9359
Brugia malayi cathepsin F-like cysteine proteinase 0.0026 0.0484 0.0637
Plasmodium vivax histone deacetylase, putative 0.0025 0.045 0.1794
Leishmania major cathepsin L-like protease 0.0082 0.2349 0.9359
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0044 0.1095 0.3767
Loa Loa (eye worm) sex muscle abnormal protein 5 0.0135 0.4127 0.4127
Onchocerca volvulus Cathepsin L homolog 0.0082 0.2349 1
Echinococcus granulosus histone deacetylase 0.0025 0.045 0.045
Schistosoma mansoni hypothetical protein 0.0049 0.1254 0.1254
Brugia malayi Papain family cysteine protease containing protein 0.0044 0.1095 0.1441
Trypanosoma cruzi cysteine peptidase, putative 0.0082 0.2349 0.516
Entamoeba histolytica cysteine protease, putative 0.0044 0.1095 0.3767
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0018 0.0239 0.0239
Schistosoma mansoni SmCB2 peptidase (C01 family) 0.0148 0.4553 0.4553
Schistosoma mansoni ran 0.0021 0.0343 0.0343
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0082 0.2349 0.9292
Echinococcus multilocularis growth factor receptor bound protein 2 0.0135 0.4127 0.4127
Trypanosoma brucei histone deacetylase 2 0.0025 0.045 0.0494
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0056 0.1494 0.3281
Echinococcus multilocularis cathepsin L cysteine protease 0.0082 0.2349 0.2349
Loa Loa (eye worm) histone deacetylase 1 0.0087 0.251 0.251
Trichomonas vaginalis histone deacetylase, putative 0.0087 0.251 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0082 0.2349 0.9292
Echinococcus granulosus histone deacetylase 8 0.0025 0.045 0.045
Loa Loa (eye worm) MH2 domain-containing protein 0.0126 0.382 0.382
Echinococcus granulosus survival motor neuron protein 1 0.0239 0.7596 0.7596
Schistosoma mansoni ran 0.0021 0.0343 0.0343
Schistosoma mansoni hypothetical protein 0.0312 1 1
Trypanosoma cruzi cruzipain precursor, putative 0.0026 0.0484 0.1062
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0082 0.2349 0.9258
Entamoeba histolytica cysteine protease, putative 0.0044 0.1095 0.3767
Plasmodium vivax serine-repeat antigen (SERA), putative 0.0018 0.0239 0.0953
Echinococcus multilocularis cathepsin L cysteine protease 0.0082 0.2349 0.2349
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0082 0.2349 0.9292
Echinococcus granulosus cathepsin b 0.0148 0.4553 0.4553
Loa Loa (eye worm) hypothetical protein 0.0082 0.2349 0.2349
Brugia malayi Cathepsin L-like precursor 0.0026 0.0484 0.0637
Echinococcus multilocularis tar DNA binding protein 0.0076 0.2175 0.2175
Schistosoma mansoni histone deacetylase 4 5 0.0025 0.045 0.045
Echinococcus multilocularis cysteine protease 0.0082 0.2349 0.2349
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0082 0.2349 0.9292
Entamoeba histolytica cysteine protease, putative 0.0044 0.1095 0.3767
Trypanosoma brucei cysteine peptidase C (CPC) 0.0058 0.1573 0.5677
Brugia malayi RNA, U transporter 1 0.0083 0.2391 0.3148
Schistosoma mansoni cathepsin F (C01 family) 0.0082 0.2349 0.2349
Toxoplasma gondii histone deacetylase HDAC5 0.0025 0.045 0.1794
Plasmodium falciparum serine repeat antigen 4 0.0018 0.0239 0.0953
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0044 0.1095 0.1095
Schistosoma mansoni histone deacetylase 0.0087 0.251 0.251
Entamoeba histolytica cysteine proteinase, putative 0.0082 0.2349 0.9292
Echinococcus granulosus histone deacetylase 6 0.0025 0.045 0.045
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.0148 0.4553 1
Echinococcus multilocularis histone deacetylase 6 0.0025 0.045 0.045
Trichomonas vaginalis histone deacetylase, putative 0.0087 0.251 1
Trichomonas vaginalis histone deacetylase, putative 0.0087 0.251 1
Leishmania major histone deacetylase, putative 0.0025 0.045 0.1794
Brugia malayi Sex muscle abnormal protein 5 0.0135 0.4127 0.5433
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0082 0.2349 0.9292
Entamoeba histolytica cysteine protease, putative 0.0044 0.1095 0.3767
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0082 0.2349 0.9292
Brugia malayi cathepsin B-like cysteine proteinase 0.0148 0.4553 0.5994
Brugia malayi RNA recognition motif domain containing protein 0.0076 0.2175 0.2863
Schistosoma mansoni cathepsin s 0.0026 0.0484 0.0484
Leishmania major histone deacetylase, putative 0.0087 0.251 1
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.0058 0.1573 0.5875
Entamoeba histolytica cysteine proteinase 1, putative 0.0044 0.1095 0.3767
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0082 0.2349 0.9292
Schistosoma mansoni histone deacetylase hda2 0.0025 0.045 0.045
Loa Loa (eye worm) hypothetical protein 0.0018 0.0239 0.0239
Leishmania major cathepsin L-like protease 0.0082 0.2349 0.9359
Brugia malayi Histone deacetylase family protein 0.0025 0.045 0.0593
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0082 0.2349 0.9292
Trypanosoma brucei importin beta-1 subunit, putative 0.0029 0.06 0.1184
Trypanosoma cruzi histone deacetylase, putative 0.0025 0.045 0.0989
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.0058 0.1573 0.3456
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0018 0.0239 0.0239
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0082 0.2349 0.9258
Trichomonas vaginalis ran, putative 0.0021 0.0343 0.0459
Trypanosoma cruzi cysteine proteinase, putative 0.0044 0.1095 0.2404
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0082 0.2349 0.9292
Plasmodium vivax vivapain-1 0.0044 0.1095 0.4361
Plasmodium vivax serine-repeat antigen 3 (SERA) 0.0018 0.0239 0.0953
Brugia malayi RNA binding protein 0.0076 0.2175 0.2863
Plasmodium falciparum histone deacetylase 1 0.0087 0.251 1
Brugia malayi Importin beta-1 subunit 0.0029 0.06 0.079
Onchocerca volvulus Cathepsin L homolog 0.0082 0.2349 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0082 0.2349 0.9292
Plasmodium vivax vivapain-3 0.0044 0.1095 0.4361
Brugia malayi cathepsin L-like precursor 0.0056 0.1494 0.1967
Echinococcus granulosus cathepsin b 0.0148 0.4553 0.4553
Entamoeba histolytica cysteine proteinase, putative 0.0044 0.1095 0.3767
Entamoeba histolytica hypothetical protein 0.0024 0.0416 0.0779
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0082 0.2349 0.9359
Entamoeba histolytica cysteine protease, putative 0.0044 0.1095 0.3767
Trypanosoma cruzi cysteine peptidase, putative 0.0082 0.2349 0.516
Plasmodium vivax unspecified product 0.0026 0.0484 0.1927
Loa Loa (eye worm) hypothetical protein 0.0018 0.0239 0.0239
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0018 0.0239 0.0239
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0082 0.2349 0.9292
Leishmania major cathepsin L-like protease 0.0082 0.2349 0.9359
Entamoeba histolytica Ran family GTPase 0.0021 0.0343 0.0459
Echinococcus multilocularis histone deacetylase 8 0.0025 0.045 0.045
Brugia malayi Papain family cysteine protease containing protein 0.0018 0.0239 0.0315
Echinococcus multilocularis survival motor neuron protein 1 0.0239 0.7596 0.7596
Plasmodium vivax serine-repeat antigen 5 (SERA) 0.0018 0.0239 0.0953
Entamoeba histolytica histone deacetylase, putative 0.0087 0.251 1
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0018 0.0239 0.0239
Schistosoma mansoni cathepsin F (C01 family) 0.0082 0.2349 0.2349
Plasmodium falciparum serine repeat antigen 5 0.0018 0.0239 0.0953
Entamoeba histolytica cysteine proteinase, putative 0.0044 0.1095 0.3767
Brugia malayi Cathepsin L-like precursor 0.0082 0.2349 0.3093
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.0087 0.251 1
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0058 0.1573 0.1573
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0044 0.1095 0.1095
Brugia malayi hypothetical protein 0.0239 0.7596 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0082 0.2349 0.9258
Echinococcus granulosus histone deacetylase 1 0.0087 0.251 0.251
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0082 0.2349 0.2349
Schistosoma mansoni growth factor receptor-bound protein 0.0135 0.4127 0.4127
Onchocerca volvulus 0.0082 0.2349 1
Loa Loa (eye worm) hypothetical protein 0.0026 0.0484 0.0484
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0082 0.2349 0.9292
Plasmodium vivax serine-repeat antigen (SERA), putative 0.0018 0.0239 0.0953
Leishmania major cathepsin L-like protease 0.0082 0.2349 0.9359
Echinococcus multilocularis histone deacetylase 6 0.0025 0.045 0.045
Schistosoma mansoni subfamily C1A unassigned peptidase (C01 family) 0.0018 0.0239 0.0239
Echinococcus granulosus cysteine protease 0.0044 0.1095 0.1095
Loa Loa (eye worm) hypothetical protein 0.0018 0.0239 0.0239
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0018 0.0239 0.0239
Brugia malayi Cathepsin L-like precursor 0.0056 0.1494 0.1967
Leishmania major cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like 0.0058 0.1573 0.6269
Plasmodium falciparum importin beta, putative 0.0029 0.06 0.239
Loa Loa (eye worm) hypothetical protein 0.0056 0.1494 0.1494
Loa Loa (eye worm) hypothetical protein 0.0148 0.4553 0.4553
Plasmodium falciparum cysteine proteinase falcipain 1 0.0044 0.1095 0.4361
Plasmodium vivax importin-beta 2, putative 0.0029 0.06 0.239
Echinococcus granulosus histone deacetylase 3 0.0087 0.251 0.251
Plasmodium falciparum serine repeat antigen 6 0.0018 0.0239 0.0953
Trypanosoma cruzi major cysteine proteinase, putative 0.0018 0.0239 0.0526
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0024 0.0416 0.0779
Echinococcus granulosus histone deacetylase 6 0.0025 0.045 0.045
Schistosoma mansoni tar DNA-binding protein 0.0076 0.2175 0.2175
Echinococcus multilocularis cathepsin b 0.0148 0.4553 0.4553
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0082 0.2349 0.9258
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0082 0.2349 0.9292
Trichomonas vaginalis importin beta-1, putative 0.0024 0.0416 0.0779
Loa Loa (eye worm) RNA binding protein 0.0076 0.2175 0.2175
Loa Loa (eye worm) cathepsin B 0.0058 0.1573 0.1573
Onchocerca volvulus Cathepsin L homolog 0.0018 0.0239 0.1019
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0082 0.2349 0.9292
Brugia malayi cathepsin L precursor 0.0018 0.0239 0.0315
Schistosoma mansoni histone deacetylase 1 2 3 0.0025 0.045 0.045
Plasmodium vivax unspecified product 0.0044 0.1095 0.4361
Trypanosoma cruzi cysteine protease, putative 0.0044 0.1095 0.2404
Leishmania major cathepsin L-like protease 0.0082 0.2349 0.9359
Leishmania major cathepsin L-like protease 0.0082 0.2349 0.9359
Leishmania major histone deacetylase, putative 0.0025 0.045 0.1794
Entamoeba histolytica cysteine protease, putative 0.0044 0.1095 0.3767
Onchocerca volvulus 0.0056 0.1494 0.6359
Toxoplasma gondii histone deacetylase HDAC2 0.0087 0.251 1
Loa Loa (eye worm) cysteine proteinase cathepsin Z 0.0018 0.0239 0.0239
Onchocerca volvulus 0.0082 0.2349 1
Entamoeba histolytica cysteine protease, putative 0.0044 0.1095 0.3767
Toxoplasma gondii histone deacetylase HDAC4 0.0025 0.045 0.1794
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0082 0.2349 0.9292
Onchocerca volvulus 0.0082 0.2349 1
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0148 0.4553 0.4553
Trypanosoma cruzi histone deacetylase 1, putative 0.0087 0.251 0.5513
Leishmania major histone deacetylase, putative 0.0087 0.251 1
Entamoeba histolytica cysteine proteinase, putative 0.0044 0.1095 0.3767
Loa Loa (eye worm) hypothetical protein 0.0018 0.0239 0.0239
Schistosoma mansoni histone deacetylase 4 5 0.0025 0.045 0.045
Onchocerca volvulus 0.0082 0.2349 1
Trypanosoma cruzi cruzipain precursor, putative 0.0082 0.2349 0.516
Echinococcus granulosus cathepsin l1 0.0082 0.2349 0.2349
Trypanosoma cruzi cysteine proteinase, putative 0.0044 0.1095 0.2404
Brugia malayi cathepsin Z-like cysteine proteinase 0.0018 0.0239 0.0315
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0082 0.2349 0.9292
Echinococcus granulosus importin subunit beta 1 0.0029 0.06 0.06
Echinococcus multilocularis histone deacetylase 0.0025 0.045 0.045
Loa Loa (eye worm) hypothetical protein 0.0026 0.0484 0.0484
Entamoeba histolytica cysteine protease, putative 0.0082 0.2349 0.9292
Plasmodium falciparum serine repeat antigen 9 0.0018 0.0239 0.0953
Plasmodium vivax histone deacetylase 1, putative 0.0087 0.251 1
Loa Loa (eye worm) hypothetical protein 0.0056 0.1494 0.1494
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0024 0.0416 0.0779
Trypanosoma brucei histone deacetylase, putative 0.0025 0.045 0.0494
Plasmodium vivax histone deacetylase 2, putative 0.0025 0.045 0.1794
Entamoeba histolytica cysteine proteinase, putative 0.0044 0.1095 0.3767
Echinococcus multilocularis cathepsin L 0.0018 0.0239 0.0239
Entamoeba histolytica cysteine protease, putative 0.0044 0.1095 0.3767
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0082 0.2349 0.9359
Loa Loa (eye worm) histone deacetylase 3 0.0087 0.251 0.251
Toxoplasma gondii histone deacetylase HDAC1 0.0025 0.045 0.1794
Schistosoma mansoni cathepsin F (C01 family) 0.0056 0.1494 0.1494
Schistosoma mansoni histone deacetylase 0.0087 0.251 0.251
Trichomonas vaginalis histone deacetylase, putative 0.0087 0.251 1
Trichomonas vaginalis histone deacetylase, putative 0.0087 0.251 1
Plasmodium vivax vivapain-2 0.0082 0.2349 0.9359
Brugia malayi Papain family cysteine protease containing protein 0.0082 0.2349 0.3093
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0082 0.2349 0.9292
Echinococcus granulosus cathepsin l cysteine peptidase 0.0082 0.2349 0.2349
Entamoeba histolytica cysteine protease, putative 0.0044 0.1095 0.3767
Echinococcus granulosus cathepsin L cysteine proteinase 0.0082 0.2349 0.2349
Loa Loa (eye worm) histone deacetylase 11 0.0025 0.045 0.045
Echinococcus granulosus growth factor receptor bound protein 2 0.0135 0.4127 0.4127
Onchocerca volvulus 0.0049 0.1254 0.5336
Brugia malayi Cathepsin L-like precursor 0.0082 0.2349 0.3093
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0082 0.2349 0.2349
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0082 0.2349 0.9258
Plasmodium falciparum dipeptidyl aminopeptidase 1 0.0018 0.0239 0.0953
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0044 0.1095 0.3767
Toxoplasma gondii histone deacetylase HDAC3 0.0087 0.251 1
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0021 0.0343 0.1368
Trypanosoma cruzi cysteine peptidase, putative 0.0044 0.1095 0.2404
Plasmodium vivax dipeptidyl aminopeptidase 3, putative 0.0018 0.0239 0.0953
Giardia lamblia Histone deacetylase 0.0087 0.251 1
Toxoplasma gondii cathepsin CPL 0.0082 0.2349 0.9359
Plasmodium falciparum serine repeat antigen 8 0.0018 0.0239 0.0953
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0312 1 1
Plasmodium falciparum histone deacetylase, putative 0.0025 0.045 0.1794
Echinococcus multilocularis snurportin 1 0.0312 1 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0082 0.2349 0.9292
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0082 0.2349 0.9292
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0044 0.1095 0.1095
Loa Loa (eye worm) hypothetical protein 0.0056 0.1494 0.1494
Giardia lamblia Cathepsin B precursor 0.0058 0.1573 0.5875
Trypanosoma brucei importin beta-1 subunit, putative 0.0029 0.06 0.1184
Loa Loa (eye worm) hypothetical protein 0.0018 0.0239 0.0239
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0076 0.2175 0.2175
Loa Loa (eye worm) cysteine protease 0.0082 0.2349 0.2349
Echinococcus multilocularis histone deacetylase 6 0.0025 0.045 0.045
Loa Loa (eye worm) hypothetical protein 0.0029 0.06 0.06
Trypanosoma cruzi histone deacetylase, putative 0.0025 0.045 0.0989
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0082 0.2349 0.9258
Brugia malayi Cathepsin L-like precursor 0.0082 0.2349 0.3093
Plasmodium falciparum histone deacetylase 2 0.0025 0.045 0.1794
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0082 0.2349 0.9258
Echinococcus granulosus cathepsin L 0.0018 0.0239 0.0239

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 12.5893 uM PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 13.1154 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 22.3872 uM PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 44.6684 uM PubChem BioAssay. qHTS for Antagonist of cAMP-regulated guanine nucleotide exchange factor 2 (EPAC2): primary screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 50.1187 um PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))] ChEMBL. No reference
Potency (functional) 100 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum 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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