Detailed information for compound 1387135

Basic information

Technical information
  • TDR Targets ID: 1387135
  • Name: 5-chloro-3-hydroxy-3-(3-methylpiperidin-1-yl) -1H-indol-2-one
  • MW: 280.75 | Formula: C14H17ClN2O2
  • H donors: 2 H acceptors: 2 LogP: 2.09 Rotable bonds: 1
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC1CCCN(C1)C1(O)C(=O)Nc2c1cc(Cl)cc2
  • InChi: 1S/C14H17ClN2O2/c1-9-3-2-6-17(8-9)14(19)11-7-10(15)4-5-12(11)16-13(14)18/h4-5,7,9,19H,2-3,6,8H2,1H3,(H,16,18)
  • InChiKey: FOSJPPHEAAXQPF-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 5-chloro-3-hydroxy-3-(3-methyl-1-piperidyl)indolin-2-one
  • 5-chloro-3-hydroxy-3-(3-methyl-1-piperidinyl)-2-indolinone
  • 5-chloro-3-hydroxy-3-(3-methyl-1-piperidyl)oxindole

Targets

Known targets for this compound

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

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Brugia malayi TAR-binding protein 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
Schistosoma mansoni 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
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
Trichomonas vaginalis set domain proteins, putative Get druggable targets OG5_131470 All targets in OG5_131470
Echinococcus multilocularis tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi Pre-SET motif family protein Get druggable targets OG5_131470 All targets in OG5_131470
Onchocerca volvulus Get druggable targets OG5_131470 All targets in OG5_131470
Brugia malayi RNA recognition motif 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
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
Loa Loa (eye worm) TAR-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
Schistosoma mansoni 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
Brugia malayi RNA binding protein 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
Onchocerca volvulus Matrilysin homolog 0.0109 0.0597 0.3125
Onchocerca volvulus 0.0154 0.0923 0.4832
Loa Loa (eye worm) apoptosis regulator protein 0.0164 0.0991 0.4052
Brugia malayi Pre-SET motif family protein 0.0251 0.162 0.6623
Mycobacterium ulcerans hydrolase 0.0133 0.0767 0.2154
Trichomonas vaginalis alcohol dehydrogenase, putative 0.0085 0.0423 0.1927
Onchocerca volvulus 0.0292 0.1911 1
Brugia malayi glutamate-cysteine ligase modifier subunit 0.0085 0.0423 0.1729
Onchocerca volvulus 0.0292 0.1911 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0085 0.0423 0.1927
Trichomonas vaginalis malate dehydrogenase, putative 0.0045 0.0137 0.0375
Onchocerca volvulus Matrix metalloproteinase homolog 0.0241 0.1548 0.8101
Loa Loa (eye worm) RNA binding protein 0.0076 0.0365 0.1493
Schistosoma mansoni apoptosis regulator bax 0.0164 0.0991 0.4052
Plasmodium vivax oxidoreductase, aldo/keto reductase domain containing protein 0.0085 0.0423 0.1381
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0076 0.0365 0.1493
Schistosoma mansoni tar DNA-binding protein 0.0076 0.0365 0.1493
Trichomonas vaginalis aldo-keto reductase, putative 0.0292 0.1911 1
Mycobacterium leprae Conserved hypothetical protein 0.0207 0.1304 0.3989
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0292 0.1911 0.1911
Mycobacterium tuberculosis Probable oxidoreductase 0.0292 0.1911 1
Trypanosoma cruzi cytosolic malate dehydrogenase, putative 0.0045 0.0137 0.0716
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0366 0.2446 1
Loa Loa (eye worm) hypothetical protein 0.0109 0.0597 0.2441
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0035 0.0113
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0035 0.0113
Trichomonas vaginalis aldo/keto reductase, putative 0.0292 0.1911 1
Brugia malayi Matrixin family protein 0.0263 0.1704 0.6968
Schistosoma mansoni pol-related 0.0292 0.1911 0.7813
Entamoeba histolytica aldose reductase, putative 0.0292 0.1911 1
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0292 0.1911 0.7813
Mycobacterium leprae PROBABLE 1-DEOXY-D-XYLULOSE 5-PHOSPHATE REDUCTOISOMERASE DXR (DXP REDUCTOISOMERASE) (1-DEOXYXYLULOSE-5-PHOSPHATE REDUCTOISOMERAS 0.0452 0.3063 1
Toxoplasma gondii LsmAD domain-containing protein 0.003 0.0035 0.0113
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0036 0.0075 0.0075
Toxoplasma gondii aldose reductase, putative 0.0292 0.1911 0.6238
Schistosoma mansoni hypothetical protein 0.0164 0.0991 0.4052
Leishmania major cytosolic malate dehydrogenase 0.0045 0.0137 0.0716
Echinococcus granulosus Bcl 2 ous antagonist:killer 0.0164 0.0991 0.0991
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0292 0.1911 0.1911
Toxoplasma gondii oxidoreductase, aldo/keto reductase family protein 0.0085 0.0423 0.1381
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0036 0.0075 0.0306
Trypanosoma cruzi aldo/keto reductase, putative 0.0292 0.1911 1
Schistosoma mansoni tar DNA-binding protein 0.0076 0.0365 0.1493
Onchocerca volvulus 0.0082 0.0401 0.21
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0035 0.0065 0.0065
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.0366 0.2446 0.2446
Brugia malayi aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase 0.0082 0.0401 0.1641
Mycobacterium leprae PROBABLE HYDROLASE 0.0133 0.0767 0.2154
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0292 0.1911 0.1911
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0366 0.2446 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0292 0.1911 0.1911
Echinococcus multilocularis aldo keto reductase 0.0292 0.1911 0.1911
Trichomonas vaginalis aldo-keto reductase, putative 0.0292 0.1911 1
Loa Loa (eye worm) oxidoreductase 0.0292 0.1911 0.7813
Loa Loa (eye worm) matrixin family protein 0.0263 0.1704 0.6968
Loa Loa (eye worm) oxidoreductase 0.0292 0.1911 0.7813
Loa Loa (eye worm) oxidoreductase 0.0292 0.1911 0.7813
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0292 0.1911 0.1911
Loa Loa (eye worm) TAR-binding protein 0.0076 0.0365 0.1493
Loa Loa (eye worm) hypothetical protein 0.0036 0.0075 0.0306
Schistosoma mansoni hypothetical protein 0.0164 0.0991 0.4052
Trichomonas vaginalis malate and lactate dehydrogenase, putative 0.0045 0.0137 0.0375
Echinococcus multilocularis aldo keto reductase 0.0292 0.1911 0.1911
Mycobacterium tuberculosis Probable peptidoglycan hydrolase 0.0133 0.0767 0.3553
Trichomonas vaginalis aldo-keto reductase, putative 0.0292 0.1911 1
Plasmodium vivax 1-deoxy-D-xylulose 5-phosphate reductoisomerase, putative 0.0452 0.3063 1
Schistosoma mansoni aldo-keto reductase 0.0292 0.1911 0.7813
Loa Loa (eye worm) hypothetical protein 0.0133 0.0767 0.3137
Toxoplasma gondii aldo/keto reductase family oxidoreductase 0.0085 0.0423 0.1381
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0292 0.1911 0.7813
Echinococcus multilocularis cytosolic malate dehydrogenase 0.0045 0.0137 0.0137
Trypanosoma brucei prostaglandin f synthase 0.0292 0.1911 1
Trichomonas vaginalis malate dehydrogenase, putative 0.0045 0.0137 0.0375
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0292 0.1911 0.1911
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0292 0.1911 0.1911
Mycobacterium leprae Possible oxidoreductase 0.0085 0.0423 0.0978
Entamoeba histolytica alcohol dehydrogenase, putative 0.0085 0.0423 0.1613
Brugia malayi NADH-dependent xylose reductase 0.0085 0.0423 0.1729
Mycobacterium ulcerans hypothetical protein 0.0085 0.0423 0.0978
Leishmania major prostaglandin f2-alpha synthase/D-arabinose dehydrogenase 0.0292 0.1911 1
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0292 0.1911 0.7813
Echinococcus multilocularis Bcl 2 ous antagonist:killer 0.0164 0.0991 0.0991
Plasmodium vivax aldehyde reductase, putative 0.0085 0.0423 0.1381
Brugia malayi Matrix metalloprotease, N-terminal domain containing protein 0.0133 0.0767 0.3137
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0292 0.1911 0.1911
Trichomonas vaginalis malate dehydrogenase, putative 0.0045 0.0137 0.0375
Onchocerca volvulus 0.0286 0.1869 0.9781
Onchocerca volvulus 0.0292 0.1911 1
Echinococcus multilocularis matrix metallopeptidase 7 (M10 family) 0.0396 0.2655 0.2655
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0292 0.1911 0.1911
Entamoeba histolytica aldose reductase, putative 0.0292 0.1911 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0292 0.1911 0.1911
Echinococcus granulosus voltage gated potassium channel subunit 0.0085 0.0423 0.0423
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0292 0.1911 0.1911
Loa Loa (eye worm) hypothetical protein 0.0292 0.1911 0.7813
Brugia malayi Pre-SET motif family protein 0.0036 0.0075 0.0306
Trichomonas vaginalis malate dehydrogenase, putative 0.0045 0.0137 0.0375
Toxoplasma gondii 1-deoxy-D-xylulose 5-phosphate reductoisomerase, putative 0.0452 0.3063 1
Trichomonas vaginalis malate and lactate dehydrogenase, putative 0.0045 0.0137 0.0375
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0292 0.1911 0.1911
Schistosoma mansoni hypothetical protein 0.0106 0.0575 0.2352
Onchocerca volvulus 0.0292 0.1911 1
Schistosoma mansoni protein tyrosine phosphatase non-receptor type nt1 0.0366 0.2446 1
Brugia malayi hypothetical protein 0.003 0.0035 0.0142
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0292 0.1911 0.7813
Toxoplasma gondii aldo-keto reductase 0.0085 0.0423 0.1381
Trichomonas vaginalis aldo-keto reductase, putative 0.0085 0.0423 0.1927
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0292 0.1911 0.1911
Onchocerca volvulus 0.0036 0.0075 0.0392
Treponema pallidum 1-deoxy-D-xylulose 5-phosphate reductoisomerase 0.0452 0.3063 0.5
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0292 0.1911 0.1911
Brugia malayi RNA binding protein 0.0076 0.0365 0.1493
Trichomonas vaginalis malate and lactate dehydrogenase, putative 0.0045 0.0137 0.0375
Schistosoma mansoni bcl-2 homologous antagonist/killer (bak) 0.0164 0.0991 0.4052
Echinococcus granulosus histone lysine methyltransferase setb 0.0036 0.0075 0.0075
Trypanosoma brucei cytosolic malate dehydrogenase 0.0045 0.0137 0.0545
Leishmania major aldehyde reductase, putative,oxidoreductase, putative 0.0292 0.1911 1
Schistosoma mansoni tar DNA-binding protein 0.0076 0.0365 0.1493
Plasmodium falciparum 1-deoxy-D-xylulose 5-phosphate reductoisomerase 0.0452 0.3063 1
Entamoeba histolytica aldose reductase, putative 0.0292 0.1911 1
Plasmodium falciparum aldehyde reductase, putative 0.0085 0.0423 0.1381
Mycobacterium leprae PROBABLE OXIDOREDUCTASE 0.0292 0.1911 0.6062
Plasmodium vivax SET domain protein, putative 0.0036 0.0075 0.0245
Giardia lamblia Aldose reductase 0.0292 0.1911 1
Brugia malayi Matrixin family protein 0.0109 0.0597 0.2441
Echinococcus granulosus aldo keto reductase 0.0292 0.1911 0.1911
Trichomonas vaginalis set domain proteins, putative 0.0286 0.1869 0.9773
Trichomonas vaginalis aldo-keto reductase, putative 0.0292 0.1911 1
Echinococcus granulosus cytosolic malate dehydrogenase 0.0045 0.0137 0.0137
Onchocerca volvulus 0.0292 0.1911 1
Brugia malayi Matrixin family protein 0.0109 0.0597 0.2441
Trichomonas vaginalis malate and lactate dehydrogenase, putative 0.0045 0.0137 0.0375
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0292 0.1911 1
Loa Loa (eye worm) matrixin family protein 0.0241 0.1548 0.6329
Echinococcus granulosus cytosolic malate dehydrogenase 0.0045 0.0137 0.0137
Loa Loa (eye worm) hypothetical protein 0.0109 0.0597 0.2441
Echinococcus granulosus L aminoadipate semialdehyde 0.0082 0.0401 0.0401
Trichomonas vaginalis aldo/keto reductase, putative 0.0292 0.1911 1
Trichomonas vaginalis malate dehydrogenase, putative 0.0045 0.0137 0.0375
Plasmodium vivax ataxin-2 like protein, putative 0.003 0.0035 0.0113
Echinococcus granulosus aldehyde reductase 0.0207 0.1304 0.1304
Echinococcus multilocularis aldehyde reductase 0.0207 0.1304 0.1304
Echinococcus multilocularis cytosolic malate dehydrogenase 0.0045 0.0137 0.0137
Trichomonas vaginalis aldo-keto reductase, putative 0.0292 0.1911 1
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0251 0.162 0.6623
Trichomonas vaginalis aldo-keto reductase, putative 0.0292 0.1911 1
Brugia malayi Matrixin family protein 0.0109 0.0597 0.2441
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0292 0.1911 0.1911
Brugia malayi Apoptosis regulator proteins, Bcl-2 family protein 0.0164 0.0991 0.4052
Trypanosoma cruzi aldo/keto reductase, putative 0.0085 0.0423 0.2214
Trichomonas vaginalis malate dehydrogenase, putative 0.0045 0.0137 0.0375
Onchocerca volvulus 0.0292 0.1911 1
Onchocerca volvulus 0.0085 0.0423 0.2214
Leishmania major hypothetical protein, conserved 0.003 0.0035 0.0182
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0036 0.0075 0.0075
Schistosoma mansoni hypothetical protein 0.0164 0.0991 0.4052
Schistosoma mansoni matrix metallopeptidase-7 (M10 family) 0.0109 0.0597 0.2441
Mycobacterium ulcerans oxidoreductase 0.0292 0.1911 0.6062
Mycobacterium tuberculosis Probable 1-deoxy-D-xylulose 5-phosphate reductoisomerase Dxr (DXP reductoisomerase) (1-deoxyxylulose-5-phosphate reductoisomeras 0.0109 0.0597 0.2594
Onchocerca volvulus 0.0109 0.0597 0.3125
Brugia malayi Matrixin family protein 0.0109 0.0597 0.2441
Schistosoma mansoni hypothetical protein 0.0154 0.0923 0.3775
Echinococcus granulosus matrix metallopeptidase 7 M10 family 0.0396 0.2655 0.2655
Schistosoma mansoni tar DNA-binding protein 0.0076 0.0365 0.1493
Trypanosoma cruzi cytosolic malate dehydrogenase, putative 0.0045 0.0137 0.0716
Echinococcus multilocularis aldo keto reductase 0.0292 0.1911 0.1911
Echinococcus multilocularis EGFP:Bcl2 fusion protein 0.1419 1 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0075 0.0306
Schistosoma mansoni potassium channel beta 0.0085 0.0423 0.1729
Trichomonas vaginalis malate dehydrogenase, putative 0.0045 0.0137 0.0375
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0075 0.0306
Chlamydia trachomatis 1-deoxy-D-xylulose 5-phosphate reductoisomerase 0.0452 0.3063 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0292 0.1911 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0075 0.0306
Mycobacterium ulcerans 1-deoxy-D-xylulose 5-phosphate reductoisomerase 0.0452 0.3063 1
Echinococcus granulosus aldo keto reductase 0.0292 0.1911 0.1911
Trichomonas vaginalis malate dehydrogenase, putative 0.0045 0.0137 0.0375
Trichomonas vaginalis conserved hypothetical protein 0.0085 0.0423 0.1927
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0036 0.0075 0.0245
Trypanosoma cruzi PAB1-binding protein , putative 0.003 0.0035 0.0182
Echinococcus granulosus tar DNA binding protein 0.0076 0.0365 0.0365
Trichomonas vaginalis aldo-keto reductase, putative 0.0292 0.1911 1
Brugia malayi Hemopexin family protein 0.0154 0.0923 0.3775
Brugia malayi Malate dehydrogenase, cytoplasmic 0.0045 0.0137 0.056
Schistosoma mansoni tar DNA-binding protein 0.0076 0.0365 0.1493
Trichomonas vaginalis malate dehydrogenase, putative 0.0045 0.0137 0.0375
Brugia malayi RNA recognition motif domain containing protein 0.0076 0.0365 0.1493
Trypanosoma brucei aldo/keto reductase, putative 0.0085 0.0423 0.2069
Schistosoma mansoni malate dehydrogenase 0.0045 0.0137 0.056
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0292 0.1911 0.1911
Onchocerca volvulus Matrilysin homolog 0.0241 0.1548 0.8101
Echinococcus multilocularis voltage gated potassium channel subunit 0.0085 0.0423 0.0423
Trichomonas vaginalis aldo-keto reductase, putative 0.0292 0.1911 1
Trypanosoma cruzi aldo-keto reductase 0.0292 0.1911 1
Loa Loa (eye worm) hypothetical protein 0.0109 0.0597 0.2441
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0292 0.1911 0.1911
Schistosoma mansoni aldo-keto reductase 0.0292 0.1911 0.7813
Plasmodium falciparum aldo-keto reductase, putative 0.0085 0.0423 0.1381
Leishmania major aldo-keto reductase-like protein 0.0292 0.1911 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0292 0.1911 0.1911
Wolbachia endosymbiont of Brugia malayi 1-deoxy-D-xylulose 5-phosphate reductoisomerase 0.0452 0.3063 0.5
Trichomonas vaginalis aldo-keto reductase, putative 0.0292 0.1911 1
Trypanosoma brucei aldo-keto reductase, putative 0.0292 0.1911 1
Loa Loa (eye worm) hypothetical protein 0.0082 0.0401 0.1641
Trichomonas vaginalis malate dehydrogenase, putative 0.0045 0.0137 0.0375
Giardia lamblia Aldose reductase 0.0292 0.1911 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0085 0.0423 0.1927
Echinococcus granulosus hypothetical protein 0.0292 0.1911 0.1911
Entamoeba histolytica alcohol dehydrogenase, putative 0.0085 0.0423 0.1613
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0292 0.1911 0.1911
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0292 0.1911 1
Loa Loa (eye worm) oxidoreductase 0.0292 0.1911 0.7813
Loa Loa (eye worm) oxidoreductase 0.0292 0.1911 0.7813
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0292 0.1911 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0292 0.1911 1
Trypanosoma brucei RNA helicase, putative 0.0106 0.0575 0.2881
Echinococcus granulosus aldo keto reductase 0.0292 0.1911 0.1911
Loa Loa (eye worm) matrix metalloproteinase 0.0109 0.0597 0.2441
Echinococcus multilocularis aldo keto reductase 0.0292 0.1911 0.1911
Echinococcus multilocularis L aminoadipate semialdehyde 0.0082 0.0401 0.0401
Trichomonas vaginalis aldo/keto reductase, putative 0.0292 0.1911 1
Loa Loa (eye worm) glutamate-cysteine ligase modifier subunit 0.0085 0.0423 0.1729
Schistosoma mansoni malate dehydrogenase 0.0045 0.0137 0.056
Brugia malayi TAR-binding protein 0.0076 0.0365 0.1493
Trichomonas vaginalis aldo-keto reductase, putative 0.0292 0.1911 1
Loa Loa (eye worm) malate dehydrogenase 0.0045 0.0137 0.056
Loa Loa (eye worm) hypothetical protein 0.003 0.0035 0.0142
Echinococcus granulosus aldo keto reductase family 1, member B4 0.0085 0.0423 0.0423
Leishmania major prostaglandin f synthase, putative 0.0292 0.1911 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0292 0.1911 0.1911
Schistosoma mansoni aminoadipate-semialdehyde dehydrogenase 0.0082 0.0401 0.1641
Mycobacterium tuberculosis Conserved protein 0.0085 0.0423 0.1613
Leishmania major aldo/keto reductase, putative,aldo/keto reductase family-like protein 0.0085 0.0423 0.2214
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.0366 0.2446 0.2446
Trypanosoma cruzi PAB1-binding protein , putative 0.003 0.0035 0.0182
Trichomonas vaginalis malate dehydrogenase, putative 0.0045 0.0137 0.0375
Loa Loa (eye worm) hypothetical protein 0.0164 0.0991 0.4052
Echinococcus multilocularis tar DNA binding protein 0.0076 0.0365 0.0365

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 1 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) 5.0119 uM PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 8.9125 uM PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 18.526 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 (binding) = 50.1187 um PUBCHEM_BIOASSAY: qHTS Assay for Identification of Novel General Anesthetics. In this assay, a GABAergic mimetic model system, apoferritin and a profluorescent 1-aminoanthracene ligand (1-AMA), was used to construct a competitive binding assay for identification of novel general anesthetics (Class of assay: confirmatory) [Related pubchem assays: 2385 (Probe Development Summary for Identification of Novel General Anesthetics), 2323 (Validation apoferritin assay run on SigmaAldrich LOPAC1280 collection)] ChEMBL. No reference
Potency (functional) 50.1187 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) 56.2341 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) 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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