Detailed information for compound 1327181

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 370.829 | Formula: C20H19ClN2O3
  • H donors: 2 H acceptors: 3 LogP: 4.42 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCn1c(=O)c(C(=O)NCCc2ccc(cc2)Cl)c(c2c1cccc2)O
  • InChi: 1S/C20H19ClN2O3/c1-2-23-16-6-4-3-5-15(16)18(24)17(20(23)26)19(25)22-12-11-13-7-9-14(21)10-8-13/h3-10,24H,2,11-12H2,1H3,(H,22,25)
  • InChiKey: UWHNKYSCJBOUPW-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens euchromatic histone-lysine N-methyltransferase 2 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Onchocerca volvulus Get druggable targets OG5_131470 All targets in OG5_131470
Trichomonas vaginalis set domain proteins, putative Get druggable targets OG5_131470 All targets in OG5_131470
Brugia malayi Pre-SET motif family protein Get druggable targets OG5_131470 All targets in OG5_131470
Loa Loa (eye worm) pre-SET domain-containing protein family protein Get druggable targets OG5_131470 All targets in OG5_131470
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
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0018 0.0173 0.0785
Schistosoma mansoni jumonji/arid domain-containing protein 0.0035 0.0547 0.2521
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0029 0.0407 0.1874
Brugia malayi Sugar transporter family protein 0.0015 0.0084 0.0143
Schistosoma mansoni lysyl-tRNA synthetase 0.0023 0.0283 0.1297
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0582 0.2685
Brugia malayi PHD-finger family protein 0.0029 0.0407 0.0723
Trypanosoma brucei glucose transporter, putative 0.0032 0.0493 0.2206
Brugia malayi serine/threonine-protein kinase plk-2 0.0094 0.1939 0.3467
Onchocerca volvulus 0.0015 0.0084 0.0125
Schistosoma mansoni glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs) 0.0031 0.0469 0.2158
Echinococcus granulosus histone lysine methyltransferase setb 0.0036 0.0582 0.2685
Giardia lamblia Kinase, PLK 0.0094 0.1939 1
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0032 0.0491 0.2259
Trichomonas vaginalis conserved hypothetical protein 0.0032 0.0493 0.0766
Trichomonas vaginalis conserved hypothetical protein 0.0027 0.0373 0.0578
Leishmania major glucose transporter, lmgt3 0.0032 0.0493 0.2206
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0143
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0036 0.0582 0.2685
Trichomonas vaginalis chromobox protein, putative 0.0068 0.1329 0.2074
Trichomonas vaginalis sugar transporter, putative 0.0032 0.0493 0.0766
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0047 0.0842 0.3888
Trypanosoma brucei glucose transporter, putative 0.0032 0.0493 0.2206
Toxoplasma gondii ABC1 family protein 0.0035 0.056 0.0847
Mycobacterium tuberculosis Probable hydrolase 0.0035 0.056 0.0978
Onchocerca volvulus 0.0015 0.0084 0.0125
Echinococcus granulosus PHD finger protein rhinoceros 0.0029 0.0407 0.1874
Onchocerca volvulus 0.0035 0.056 0.0871
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0035 0.0551 0.2542
Trypanosoma brucei THT1 - hexose transporter, putative 0.0032 0.0493 0.2206
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0041 0.07 0.109
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0094 0.1939 0.8981
Echinococcus granulosus Sugar transporter ERD6 protein 0.0015 0.0084 0.0372
Schistosoma mansoni glucose transport protein 0.0104 0.2159 1
Entamoeba histolytica protein kinase, putative 0.0032 0.0491 0.2516
Echinococcus multilocularis General substrate transporter 0.0089 0.1819 0.8425
Trypanosoma cruzi hexose transporter, putative 0.0018 0.0153 0.0376
Trypanosoma cruzi prolyl-tRNA synthetase, putative 0.0036 0.0589 0.2721
Schistosoma mansoni jumonji domain containing protein 0.0074 0.147 0.6804
Echinococcus multilocularis chromobox protein 1 0.0068 0.1329 0.615
Trypanosoma cruzi hexose transporter, putative 0.0032 0.0493 0.2206
Loa Loa (eye worm) jmjC domain-containing protein 0.0035 0.0547 0.0973
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0143
Echinococcus granulosus peregrin 0.0029 0.0407 0.1874
Schistosoma mansoni serine/threonine protein kinase 0.0032 0.0491 0.2259
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0018 0.0173 0.0303
Plasmodium vivax lysine--tRNA ligase, putative 0.0023 0.0283 0.028
Brugia malayi Bifunctional aminoacyl-tRNA synthetase 0.0031 0.0469 0.0833
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.056 0.0871
Mycobacterium leprae conserved hypothetical protein 0.0035 0.056 1
Toxoplasma gondii PHD-finger domain-containing protein 0.0029 0.0407 0.0615
Echinococcus granulosus General substrate transporter 0.0089 0.1819 0.8425
Giardia lamblia Prolyl-tRNA synthetase 0.0031 0.0469 0.2074
Loa Loa (eye worm) hypothetical protein 0.003 0.0441 0.0783
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Onchocerca volvulus 0.0015 0.0084 0.0125
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Schistosoma mansoni jumonji/arid domain-containing protein 0.0035 0.0547 0.2521
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0582 0.2685
Trichomonas vaginalis conserved hypothetical protein 0.0015 0.0084 0.0125
Echinococcus granulosus lysine specific demethylase 5A 0.0035 0.0547 0.2521
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0018 0.0173 0.0183
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Toxoplasma gondii exonuclease III APE 0.0018 0.0173 0.0258
Echinococcus granulosus glutamyl tRNA synthetase cytoplasmic 0.0031 0.0469 0.2158
Schistosoma mansoni inositol monophosphatase 0.0038 0.0638 0.2945
Trypanosoma brucei glucose transporter 2A 0.0032 0.0493 0.2206
Plasmodium vivax SET domain protein, putative 0.0036 0.0582 0.0579
Echinococcus multilocularis lysine specific demethylase 5A 0.0035 0.0547 0.2521
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0143
Loa Loa (eye worm) hypothetical protein 0.0035 0.056 0.0997
Brugia malayi chromobox protein homolog 3 0.0038 0.0633 0.1127
Toxoplasma gondii sugar transporter ST1 0.0015 0.0084 0.0122
Mycobacterium leprae Possible lysyl-tRNA synthetase 2 LysX 0.0023 0.0283 0.2267
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0038 0.0638 0.2989
Echinococcus granulosus Chromobox protein 3 0.0011 0.0004 0.00000016287
Trichomonas vaginalis conserved hypothetical protein 0.0015 0.0084 0.0125
Trichomonas vaginalis lysyl-tRNA synthetase, putative 0.002 0.0217 0.0333
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0038 0.0638 0.2989
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0032 0.0491 0.2259
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0143
Leishmania major hypothetical protein, conserved 0.0035 0.056 0.2568
Plasmodium vivax calcium-dependent protein kinase, putative 0.0032 0.0491 0.0488
Mycobacterium tuberculosis Conserved protein 0.0035 0.056 0.0978
Loa Loa (eye worm) CAMK/CAMK2 protein kinase 0.0032 0.0491 0.0872
Plasmodium vivax calcium-dependent protein kinase 3, putative 0.0032 0.0491 0.0488
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0035 0.056 0.0997
Echinococcus multilocularis solute carrier family 2, facilitated glucose 0.0104 0.2159 1
Echinococcus granulosus inositol monophosphatase 1 0.0038 0.0638 0.2945
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0045 0.0781 0.1392
Mycobacterium tuberculosis Lysyl-tRNA synthetase 2 LysX 0.002 0.0202 0.0243
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Echinococcus multilocularis calcium dependent protein kinase 0.003 0.0438 0.2015
Loa Loa (eye worm) major facilitator superfamily transporter 0.0015 0.0084 0.0143
Loa Loa (eye worm) jmjC domain-containing protein 0.0059 0.1114 0.1988
Onchocerca volvulus 0.0015 0.0084 0.0125
Schistosoma mansoni ap endonuclease 0.0018 0.0173 0.0785
Onchocerca volvulus 0.0035 0.056 0.0871
Loa Loa (eye worm) hypothetical protein 0.0031 0.0469 0.0833
Loa Loa (eye worm) beta-lactamase 0.0035 0.056 0.0997
Onchocerca volvulus Serine\/threonine kinase homolog 0.0094 0.1939 0.3029
Trypanosoma brucei glucose transporter 1E 0.0032 0.0493 0.2206
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0032 0.0491 0.2259
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0143
Trichomonas vaginalis conserved hypothetical protein 0.0038 0.0633 0.0984
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Plasmodium falciparum phd finger protein, putative 0.0029 0.0407 0.0404
Mycobacterium ulcerans integral membrane transport protein 0.0015 0.0084 0.131
Plasmodium vivax hypothetical protein, conserved 0.0029 0.0407 0.0404
Echinococcus multilocularis solute carrier family 22 0.0015 0.0084 0.0372
Loa Loa (eye worm) hypothetical protein 0.0049 0.0881 0.1572
Trichomonas vaginalis CAMK family protein kinase 0.0094 0.1939 0.3029
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0018 0.0173 0.1607
Toxoplasma gondii cell-cycle-associated protein kinase MAPK, putative 0.0168 0.3653 0.5555
Trichomonas vaginalis conserved hypothetical protein 0.0104 0.2159 0.3373
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0018 0.0173 0.0169
Onchocerca volvulus 0.003 0.0441 0.0684
Trichomonas vaginalis CAMK family protein kinase 0.0094 0.1939 0.3029
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0032 0.0491 0.2259
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0032 0.0491 0.2259
Onchocerca volvulus 0.0015 0.0084 0.0125
Plasmodium falciparum calcium-dependent protein kinase 1 0.0032 0.0491 0.0488
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0224 0.4958 1
Toxoplasma gondii protein kinase, putative 0.0294 0.6574 1
Entamoeba histolytica serine/threonine protein kinase, putative 0.0094 0.1939 1
Brugia malayi Heterochromatin protein 1 0.0068 0.1329 0.2374
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Brugia malayi hypothetical protein 0.0015 0.0084 0.0143
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0094 0.1939 1
Trichomonas vaginalis conserved hypothetical protein 0.0015 0.0084 0.0125
Echinococcus multilocularis glutamyl tRNA synthetase cytoplasmic 0.0031 0.0469 0.2158
Echinococcus multilocularis Sugar transporter ERD6 protein 0.0015 0.0084 0.0372
Echinococcus multilocularis chromobox protein 1 0.0068 0.1329 0.615
Leishmania major prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative 0.0036 0.0589 0.2721
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0104 0.2159 1
Echinococcus multilocularis PHD finger protein rhinoceros 0.0029 0.0407 0.1874
Treponema pallidum exodeoxyribonuclease (exoA) 0.0018 0.0173 1
Trichomonas vaginalis sugar transporter, putative 0.0032 0.0493 0.0766
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.056 0.2568
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0094 0.1939 0.8981
Brugia malayi Cam kinase protein 1 0.0032 0.0491 0.0872
Trichomonas vaginalis conserved hypothetical protein 0.0027 0.0373 0.0578
Schistosoma mansoni hypothetical protein 0.0104 0.2159 1
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0143
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.056 0.0871
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.056 0.0871
Trichomonas vaginalis glucose transporter, putative 0.0032 0.0493 0.0766
Trichomonas vaginalis CAMK family protein kinase 0.0048 0.0854 0.1331
Trypanosoma cruzi hexose transporter, putative 0.0032 0.0493 0.2206
Echinococcus granulosus chromobox protein 1 0.0068 0.1329 0.615
Schistosoma mansoni glucose transporter 0.0015 0.0084 0.0372
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0038 0.0638 1
Plasmodium vivax sugar transporter, putative 0.0015 0.0084 0.008
Brugia malayi bifunctional aminoacyl-tRNA synthetase 0.0031 0.0469 0.0833
Echinococcus granulosus solute carrier family 22 0.0015 0.0084 0.0372
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Mycobacterium tuberculosis Conserved protein 0.0035 0.056 0.0978
Schistosoma mansoni kinase 0.0049 0.0882 0.4078
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0045 0.0781 0.1392
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0104 0.2159 1
Echinococcus multilocularis Chromobox protein 3 0.0011 0.0004 0.00000016287
Onchocerca volvulus 0.0015 0.0084 0.0125
Toxoplasma gondii sugar transporter ST3 0.0015 0.0084 0.0122
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0781 0.3607
Echinococcus multilocularis lysyl tRNA synthetase 0.0023 0.0283 0.1297
Mycobacterium tuberculosis Probable lipase LipE 0.0035 0.056 0.0978
Plasmodium falciparum calcium-dependent protein kinase 3 0.0032 0.0491 0.0488
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0143
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0035 0.056 0.0978
Trypanosoma cruzi hexose transporter 0.0032 0.0493 0.2206
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0032 0.0491 0.2259
Brugia malayi Pre-SET motif family protein 0.0036 0.0582 0.1036
Toxoplasma gondii sugar transporter ST2 0.0015 0.0084 0.0122
Brugia malayi beta-lactamase family protein 0.0035 0.056 0.0997
Trichomonas vaginalis prolyl-tRNA synthetase, putative 0.0031 0.0469 0.0728
Echinococcus granulosus lysyl tRNA synthetase 0.0023 0.0283 0.1297
Brugia malayi Pre-SET motif family protein 0.0251 0.5587 1
Trichomonas vaginalis CAMK family protein kinase 0.0094 0.1939 0.3029
Brugia malayi Sugar transporter family protein 0.0015 0.0084 0.0143
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0038 0.0638 0.2989
Onchocerca volvulus 0.0015 0.0084 0.0125
Echinococcus granulosus calcium dependent protein kinase 0.003 0.0438 0.2015
Trichomonas vaginalis ap endonuclease, putative 0.0018 0.0173 0.0265
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0104 0.2159 1
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0018 0.0173 0.048
Trichomonas vaginalis lysyl-tRNA synthetase, putative 0.0023 0.0283 0.0437
Plasmodium falciparum hexose transporter 0.0104 0.2159 0.2156
Chlamydia trachomatis lysine--tRNA ligase 0.0023 0.0283 1
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0018 0.0173 0.0874
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0093 0.1916 0.8875
Mycobacterium tuberculosis Probable esterase LipL 0.0035 0.056 0.0978
Loa Loa (eye worm) hypothetical protein 0.0036 0.0582 0.1036
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0582 0.2685
Toxoplasma gondii prolyl-tRNA synthetase (ProRS) 0.0036 0.0589 0.0891
Toxoplasma gondii PHD-finger domain-containing protein 0.0029 0.0407 0.0615
Schistosoma mansoni sugar transporter 0.0015 0.0084 0.0372
Mycobacterium ulcerans sugar-transport integral membrane protein SugI 0.0015 0.0084 0.131
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0034 0.0545 0.9567
Schistosoma mansoni sugar transporter 0.0015 0.0084 0.0372
Brugia malayi Major Facilitator Superfamily protein 0.0015 0.0084 0.0143
Trypanosoma cruzi hexose transporter, putative 0.0032 0.0493 0.2206
Trypanosoma cruzi lysyl-tRNA synthetase, putative 0.0023 0.0283 0.1075
Trichomonas vaginalis CAMK family protein kinase 0.0094 0.1939 0.3029
Trypanosoma brucei glucose transporter, putative 0.0032 0.0493 0.2206
Brugia malayi major facilitator superfamily protein 0.0015 0.0084 0.0143
Brugia malayi beta-lactamase 0.0035 0.056 0.0997
Brugia malayi hypothetical protein 0.0015 0.0084 0.0143
Loa Loa (eye worm) major facilitator superfamily transporter 0.0015 0.0084 0.0143
Leishmania major glucose transporter, lmgt2 0.0032 0.0493 0.2206
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.0034 0.0545 0.0946
Mycobacterium ulcerans sugar transporter 0.0015 0.0084 0.131
Onchocerca volvulus 0.0047 0.0842 0.1311
Schistosoma mansoni glucose transport protein 0.0104 0.2159 1
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Trichomonas vaginalis conserved hypothetical protein 0.0015 0.0084 0.0125
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Trichomonas vaginalis conserved hypothetical protein 0.0038 0.0633 0.0984
Echinococcus multilocularis inositol monophosphatase 1 0.0038 0.0638 0.2945
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0143
Plasmodium falciparum major facilitator superfamily domain-containing protein, putative 0.0015 0.0084 0.008
Plasmodium vivax proline--tRNA ligase, putative 0.0036 0.0589 0.0585
Trichomonas vaginalis inositol monophosphatase, putative 0.0038 0.0638 0.0993
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0038 0.0638 0.328
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0036 0.0582 0.2685
Loa Loa (eye worm) hypothetical protein 0.0038 0.0633 0.1127
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0781 0.3607
Schistosoma mansoni chromobox protein 0.0068 0.1329 0.615
Trypanosoma cruzi polo-like protein kinase, putative 0.0094 0.1939 1
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0143
Schistosoma mansoni ap endonuclease 0.0018 0.0173 0.0785
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0038 0.0638 0.2989
Trichomonas vaginalis penicillin-binding protein, putative 0.0035 0.056 0.0871
Echinococcus granulosus solute carrier family 22 0.0015 0.0084 0.0372
Plasmodium vivax calcium-dependent protein kinase 4, putative 0.0032 0.0491 0.0488
Brugia malayi Major Facilitator Superfamily protein 0.0015 0.0084 0.0143
Brugia malayi Bromodomain containing protein 0.0029 0.0407 0.0723
Loa Loa (eye worm) hypothetical protein 0.0031 0.0469 0.0833
Loa Loa (eye worm) PHD-finger family protein 0.0029 0.0407 0.0723
Leishmania major protein kinase, putative 0.0032 0.0491 0.2193
Brugia malayi hypothetical protein 0.0015 0.0084 0.0143
Trichomonas vaginalis conserved hypothetical protein 0.0015 0.0084 0.0125
Plasmodium falciparum mitogen-activated protein kinase 2 0.0168 0.3653 0.3651
Trypanosoma brucei THT1 - hexose transporter, putative 0.0032 0.0493 0.2206
Echinococcus granulosus solute carrier family 22 0.0015 0.0084 0.0372
Loa Loa (eye worm) heterochromatin protein 1 0.0068 0.1329 0.2374
Plasmodium vivax hexose transporter 0.0104 0.2159 0.2156
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Brugia malayi Sugar transporter family protein 0.0104 0.2159 0.386
Trypanosoma brucei glucose transporter, putative 0.0032 0.0493 0.2206
Toxoplasma gondii calcium-dependent protein kinase CDPK2A 0.0032 0.0491 0.0742
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0035 0.056 0.0997
Plasmodium vivax CDK-related protein kinase 6, putative 0.0441 1 1
Brugia malayi lysyl-tRNA synthetase 0.0023 0.0283 0.0501
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0143
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 1 0.0032 0.0491 0.2259
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0104 0.2159 1
Leishmania major glucose transporter, lmgt1 0.0032 0.0493 0.2206
Toxoplasma gondii calcium-dependent protein kinase CDPK2B 0.0032 0.0491 0.0742
Loa Loa (eye worm) hypothetical protein 0.0035 0.056 0.0997
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0018 0.0173 0.048
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0104 0.2159 1
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0018 0.0173 0.048
Loa Loa (eye worm) hypothetical protein 0.0023 0.0283 0.0501
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0038 0.0638 1
Brugia malayi major facilitator superfamily protein 0.0015 0.0084 0.0143
Trichomonas vaginalis chromobox protein, putative 0.0041 0.07 0.109
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Schistosoma mansoni glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs) 0.0031 0.0469 0.2158
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Echinococcus granulosus chromobox protein 1 0.0068 0.1329 0.615
Trichomonas vaginalis esterase, putative 0.0035 0.056 0.0871
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0018 0.0173 0.2707
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0018 0.0173 0.0785
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0781 0.3607
Brugia malayi beta-lactamase family protein 0.0035 0.056 0.0997
Onchocerca volvulus 0.0011 0.0004 0.000000054929
Onchocerca volvulus 0.0015 0.0084 0.0125
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0251 0.5587 1
Leishmania major glucose transporter/membrane transporter D2, putative 0.0032 0.0493 0.2206
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0018 0.0173 0.048
Trypanosoma brucei hypothetical protein, conserved 0.0035 0.056 0.2568
Mycobacterium tuberculosis Conserved protein 0.0035 0.056 0.0978
Trichomonas vaginalis conserved hypothetical protein 0.0032 0.0493 0.0766
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Plasmodium falciparum calcium-dependent protein kinase 5 0.0032 0.0491 0.0488
Trichomonas vaginalis sugar transport protein, putative 0.0015 0.0084 0.0125
Schistosoma mansoni protein kinase 0.0032 0.0491 0.2259
Onchocerca volvulus Putative transporter 0.0015 0.0084 0.0125
Mycobacterium ulcerans fusion protein of transposase for IS2606 and sialic acid-transport integral membrane protein NanT 0.0015 0.0084 0.131
Onchocerca volvulus 0.0015 0.0084 0.0125
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0143
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0104 0.2159 1
Onchocerca volvulus 0.0035 0.056 0.0871
Loa Loa (eye worm) sugar transporter 0.0015 0.0084 0.0143
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Trypanosoma brucei glucose transporter, putative 0.0032 0.0493 0.2206
Loa Loa (eye worm) sugar transporter 0.0104 0.2159 0.386
Entamoeba histolytica hypothetical protein 0.0023 0.0283 0.1444
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0143
Loa Loa (eye worm) inositol-1 0.0038 0.0638 0.1137
Trichomonas vaginalis CAMK family protein kinase 0.0032 0.0491 0.0762
Trichomonas vaginalis chromobox protein, putative 0.0041 0.07 0.109
Loa Loa (eye worm) hypothetical protein 0.0035 0.056 0.0997
Loa Loa (eye worm) hypothetical protein 0.0032 0.0491 0.0872
Trypanosoma brucei glucose transporter, putative 0.0032 0.0493 0.2206
Loa Loa (eye worm) hypothetical protein 0.0029 0.0407 0.0723
Mycobacterium leprae Probable lipase LipE 0.0035 0.056 1
Plasmodium falciparum lysine--tRNA ligase 0.0023 0.0283 0.028
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0143
Plasmodium falciparum proline--tRNA ligase 0.0036 0.0589 0.0585
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0038 0.0638 0.0993
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0038 0.0638 0.0966
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0038 0.0638 0.0993
Toxoplasma gondii calcium-dependent protein kinase CDPK3 0.0032 0.0491 0.0742
Toxoplasma gondii transporter, major facilitator family protein 0.0015 0.0084 0.0122
Plasmodium vivax calcium-dependent protein kinase 1, putative 0.0032 0.0491 0.0488
Loa Loa (eye worm) hypothetical protein 0.0035 0.056 0.0997
Plasmodium falciparum calcium-dependent protein kinase 4 0.0032 0.0491 0.0488
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Schistosoma mansoni sugar transporter 0.0015 0.0084 0.0372
Trichomonas vaginalis penicillin-binding protein, putative 0.0035 0.056 0.0871
Trichomonas vaginalis CAMK family protein kinase 0.0048 0.0854 0.1331
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0038 0.0633 0.0984
Trypanosoma cruzi prolyl-tRNA synthetase, putative 0.0036 0.0589 0.2721
Echinococcus granulosus solute carrier family 22 0.0015 0.0084 0.0372
Giardia lamblia Lysyl-tRNA synthetase 0.0023 0.0283 0.1075
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.056 0.2568
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Brugia malayi SET domain containing protein 0.0012 0.0034 0.0055
Trichomonas vaginalis glucose transporter, putative 0.0015 0.0084 0.0125
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0018 0.0173 0.0169
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0032 0.0491 0.2259
Leishmania major prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative 0.0036 0.0589 0.2721
Brugia malayi Calcium/calmodulin-dependent protein kinase type II alpha chain 0.0032 0.0491 0.0872
Echinococcus multilocularis solute carrier family 22 0.0015 0.0084 0.0372
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Mycobacterium ulcerans lipase LipD 0.0035 0.056 0.8775
Entamoeba histolytica protein kinase, putative 0.0032 0.0491 0.2516
Schistosoma mansoni chromobox protein 0.0068 0.1329 0.615
Plasmodium falciparum calcium-dependent protein kinase 2 0.0032 0.0491 0.0488
Mycobacterium ulcerans lysyl-tRNA synthetase 0.0023 0.0283 0.4435
Trypanosoma brucei polo-like protein kinase 0.0094 0.1939 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.056 0.0997
Mycobacterium ulcerans lysyl-tRNA synthetase 0.0023 0.0283 0.4435
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0093 0.1916 0.8875
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0035 0.056 0.0978
Plasmodium vivax hypothetical protein, conserved 0.0035 0.056 0.0557
Trichomonas vaginalis ap endonuclease, putative 0.0018 0.0173 0.0265
Schistosoma mansoni glucose transport protein 0.0104 0.2159 1
Trichomonas vaginalis sugar transporter, putative 0.0032 0.0493 0.0766
Plasmodium vivax mitogen-activated protein kinase 2, putative 0.0168 0.3653 0.3651
Schistosoma mansoni serine/threonine protein kinase 0.0094 0.1939 0.8981
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0781 0.3607
Leishmania major lysyl-tRNA synthetase, putative 0.0023 0.0283 0.1075
Onchocerca volvulus 0.0286 0.6394 1
Brugia malayi Inositol-1 0.0038 0.0638 0.1137
Loa Loa (eye worm) calcium/calmodulin-dependent protein kinase ID 0.0032 0.0491 0.0872
Schistosoma mansoni hypothetical protein 0.0029 0.0407 0.1874
Schistosoma mansoni sugar transporter 0.0015 0.0084 0.0372
Mycobacterium ulcerans beta-lactamase 0.0035 0.056 0.8775
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Trypanosoma brucei THT1 - hexose transporter, putative 0.0032 0.0493 0.2206
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0104 0.2159 1
Mycobacterium tuberculosis Lysyl-tRNA synthetase 1 LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase) 0.002 0.0202 0.0243
Schistosoma mansoni nuclear transcription factor X-box binding 1 (nfx1) 0.0015 0.0084 0.0372
Schistosoma mansoni protein kinase 0.0032 0.0491 0.2259
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0143
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.056 0.2583
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0035 0.056 0.0978
Brugia malayi exodeoxyribonuclease III family protein 0.0018 0.0173 0.0303
Schistosoma mansoni protein kinase 0.0032 0.0491 0.2259
Trypanosoma brucei bifunctional aminoacyl-tRNA synthetase, putative 0.0036 0.0589 0.2721
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Brugia malayi Major Facilitator Superfamily protein 0.0015 0.0084 0.0143
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Brugia malayi jmjC domain containing protein 0.0035 0.0547 0.0973
Onchocerca volvulus Alhambra homolog 0.0029 0.0407 0.0632
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0781 0.3607
Onchocerca volvulus 0.0015 0.0084 0.0125
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0018 0.0173 0.048
Echinococcus multilocularis synaptic vesicle 2 protein 0.0015 0.0084 0.0372
Echinococcus multilocularis solute carrier family 22 0.0015 0.0084 0.0372
Plasmodium falciparum protein kinase 7 0.0294 0.6574 0.6572
Echinococcus granulosus jumonji domain containing protein 0.004 0.0667 0.3079
Onchocerca volvulus 0.0015 0.0084 0.0125
Loa Loa (eye worm) bifunctional aminoacyl-tRNA synthetase 0.0013 0.0041 0.0068
Trichomonas vaginalis CAMK family protein kinase 0.0094 0.1939 0.3029
Entamoeba histolytica prolyl-tRNA synthetase, putative 0.0031 0.0469 0.2402
Mycobacterium ulcerans hypothetical protein 0.0035 0.056 0.8775
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Trichomonas vaginalis glucose transporter, putative 0.0032 0.0493 0.0766
Schistosoma mansoni lysyl-tRNA synthetase 0.0023 0.0283 0.1297
Echinococcus multilocularis peregrin 0.0029 0.0407 0.1874
Onchocerca volvulus 0.0015 0.0084 0.0125
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Trypanosoma brucei calcium/calmodulin-dependent protein kinase, putative 0.0032 0.0491 0.2193
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0781 0.3607
Onchocerca volvulus 0.0015 0.0084 0.0125
Loa Loa (eye worm) hypothetical protein 0.0025 0.0333 0.059
Toxoplasma gondii facilitative glucose transporter GT1 0.0104 0.2159 0.3281
Echinococcus multilocularis solute carrier family 22 0.0015 0.0084 0.0372
Mycobacterium tuberculosis Probable lipase LipD 0.0035 0.056 0.0978
Onchocerca volvulus 0.0015 0.0084 0.0125
Trichomonas vaginalis set domain proteins, putative 0.0286 0.6394 1
Echinococcus multilocularis jumonji domain containing protein 0.004 0.0667 0.3079
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0094 0.1939 0.3467
Brugia malayi jmjC domain containing protein 0.0093 0.1916 0.3426
Trypanosoma brucei glucose transporter, putative 0.0032 0.0493 0.2206
Echinococcus multilocularis beta LACTamase domain containing family member 0.0035 0.056 0.2583
Mycobacterium leprae Probable prolyl tRNA synthetase ProS 0.0031 0.0469 0.7443
Trichomonas vaginalis myo-inositol transporter, putative 0.0015 0.0084 0.0125
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0781 0.3607
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0035 0.056 0.8775
Onchocerca volvulus 0.0015 0.0084 0.0125
Schistosoma mansoni inositol monophosphatase 0.0038 0.0638 0.2945
Echinococcus granulosus synaptic vesicle 2 protein 0.0015 0.0084 0.0372
Giardia lamblia PHD finger protein 15 0.0029 0.0407 0.1745
Trichomonas vaginalis CAMK family protein kinase 0.0094 0.1939 0.3029
Toxoplasma gondii lysine-tRNA ligase 0.0023 0.0283 0.0426
Trypanosoma brucei glucose transporter, putative 0.0032 0.0493 0.2206
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Loa Loa (eye worm) hypothetical protein 0.0035 0.056 0.0997
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Mycobacterium ulcerans esterase/lipase LipP 0.0035 0.056 0.8775
Trypanosoma cruzi polo-like protein kinase, putative 0.0094 0.1939 1
Trichomonas vaginalis chromobox protein, putative 0.0068 0.1329 0.2074
Trypanosoma brucei lysyl-tRNA synthetase, putative 0.0023 0.0283 0.1075
Echinococcus granulosus beta LACTamase domain containing family member 0.0035 0.056 0.2583
Trichomonas vaginalis CAMK family protein kinase 0.0094 0.1939 0.3029
Trichomonas vaginalis sugar transporter, putative 0.0015 0.0084 0.0125
Loa Loa (eye worm) hypothetical protein 0.0015 0.0084 0.0143
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.056 0.2583
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0036 0.0582 0.0881
Onchocerca volvulus 0.0015 0.0084 0.0125

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 2.9362 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) 4.4668 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) = 22.3872 um PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 28.1838 uM PubChem BioAssay. qHTS Assay for Activators of ClpP. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 70.7946 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) 89.1251 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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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