Detailed information for compound 1301930

Basic information

Technical information
  • TDR Targets ID: 1301930
  • Name: 5-amino-8-methylchroman-4-one
  • MW: 177.2 | Formula: C10H11NO2
  • H donors: 1 H acceptors: 1 LogP: 1.61 Rotable bonds: 0
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1ccc(c2c1OCCC2=O)N
  • InChi: 1S/C10H11NO2/c1-6-2-3-7(11)9-8(12)4-5-13-10(6)9/h2-3H,4-5,11H2,1H3
  • InChiKey: IHYMOUOJCUVYSO-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 5-amino-8-methyl-chroman-4-one
  • 5-amino-8-methyl-4-chromanone
  • 5-amino-8-methyl-2,3-dihydro-4H-chromen-4-one
  • MLS000700140
  • SMR000229354
  • AO-079/15259046
  • Oprea1_313852
  • ZINC04649468

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens geminin, DNA replication inhibitor Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi Hypothetical 65.5 kDa Trp-Asp repeats containing protein F02E8.5 inchromosome X geminin, DNA replication inhibitor 209 aa 176 aa 27.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0038 0.0177 0.1725
Brugia malayi follicle stimulating hormone receptor 0.0226 0.2384 0.4732
Trichomonas vaginalis set domain proteins, putative 0.024 0.255 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0138 0.1349 0.2678
Echinococcus granulosus geminin 0.0672 0.7637 1
Loa Loa (eye worm) MH2 domain-containing protein 0.0124 0.1188 0.2358
Echinococcus multilocularis geminin 0.0672 0.7637 0.7637
Brugia malayi MH2 domain containing protein 0.0124 0.1188 0.2358
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0138 0.1349 0.2678
Loa Loa (eye worm) hypothetical protein 0.011 0.1023 0.2032
Schistosoma mansoni hypothetical protein 0.0032 0.0097 0.0127
Loa Loa (eye worm) RNA binding protein 0.0064 0.0477 0.0947
Echinococcus granulosus long chain fatty acid transport protein 4 0.0434 0.483 0.6324
Leishmania major glycosyl hydrolase-like protein 0.0028 0.0057 0.0119
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0076 0.0615 0.241
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0029 0.0069 0.009
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD6 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0428 0.4763 0.5942
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0038 0.0173 0.0344
Schistosoma mansoni hypothetical protein 0.0672 0.7637 1
Brugia malayi AMP-binding enzyme family protein 0.0451 0.5037 1
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0028 0.0057 0.0925
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.011 0.1023 0.134
Schistosoma mansoni hypothetical protein 0.0672 0.7637 1
Trypanosoma cruzi flap endonuclease-1 (FEN-1), putative 0.0026 0.0035 0.0072
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0038 0.0177 0.0177
Schistosoma mansoni flap endonuclease-1 0.0024 0.0005 0.0007
Toxoplasma gondii flap structure-specific endonuclease 1, putative 0.0026 0.0035 0.0339
Loa Loa (eye worm) flap endonuclease-1 0.0026 0.0035 0.0069
Schistosoma mansoni transcription factor LCR-F1 0.0071 0.0559 0.0732
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0076 0.0615 0.241
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0038 0.0177 0.0366
Loa Loa (eye worm) hypothetical protein 0.0032 0.0097 0.0193
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0028 0.0057 0.0223
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.003 0.0082 0.0082
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0038 0.0177 0.022
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 0.0038 0.0173 0.0227
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0028 0.0057 0.0223
Brugia malayi Flap endonuclease-1 0.0026 0.0035 0.0069
Loa Loa (eye worm) hypothetical protein 0.023 0.2436 0.4836
Brugia malayi Pre-SET motif family protein 0.003 0.0082 0.0162
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0038 0.0173 0.068
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.011 0.1023 0.2032
Schistosoma mansoni survival motor neuron protein 0.0047 0.0279 0.0365
Trichomonas vaginalis alpha-glucosidase, putative 0.0028 0.0057 0.0223
Mycobacterium tuberculosis Probable lipase LipD 0.011 0.1023 0.1277
Loa Loa (eye worm) hypothetical protein 0.011 0.1023 0.2032
Trichomonas vaginalis penicillin-binding protein, putative 0.011 0.1023 0.4013
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0138 0.1349 0.1767
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0038 0.0173 0.0363
Brugia malayi Glycosyl hydrolases family 31 protein 0.034 0.3731 0.7406
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0138 0.1349 0.1767
Echinococcus multilocularis tar DNA binding protein 0.0064 0.0477 0.0477
Trichomonas vaginalis esterase, putative 0.011 0.1023 0.4013
Plasmodium vivax ataxin-2 like protein, putative 0.0052 0.0336 0.3285
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0032 0.0097 0.0097
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.034 0.3731 0.7406
Leishmania major flap endonuclease-1 (FEN-1), putative 0.0026 0.0035 0.0073
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0038 0.0177 0.035
Loa Loa (eye worm) transcription factor SMAD2 0.0124 0.1188 0.2358
Entamoeba histolytica hypothetical protein 0.0071 0.0559 0.9091
Toxoplasma gondii ABC1 family protein 0.011 0.1023 1
Loa Loa (eye worm) hypothetical protein 0.011 0.1023 0.2032
Loa Loa (eye worm) hypothetical protein 0.011 0.1023 0.2032
Mycobacterium ulcerans long-chain-acyl-CoA synthetase 0.0451 0.5037 1
Plasmodium vivax SET domain protein, putative 0.003 0.0082 0.0799
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.003 0.0082 0.0107
Brugia malayi RNA binding protein 0.0064 0.0477 0.0947
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0076 0.0615 1
Onchocerca volvulus 0.0197 0.2042 0.8008
Loa Loa (eye worm) hypothetical protein 0.0028 0.0057 0.0113
Schistosoma mansoni hypothetical protein 0.0032 0.0097 0.0127
Trichomonas vaginalis alpha-glucosidase, putative 0.0028 0.0057 0.0223
Brugia malayi Calcitonin receptor-like protein seb-1 0.01 0.0899 0.1785
Trichomonas vaginalis ap endonuclease, putative 0.0038 0.0177 0.0692
Schistosoma mansoni hypothetical protein 0.0032 0.0097 0.0127
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 0.0038 0.0173 0.0173
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0226 0.2384 0.4732
Mycobacterium ulcerans lipase LipD 0.011 0.1023 0.2032
Loa Loa (eye worm) hypothetical protein 0.0068 0.0528 0.1048
Onchocerca volvulus Uncharacterized family 31 glucosidase KIAA1161 homolog 0.0028 0.0057 0.0223
Loa Loa (eye worm) TAR-binding protein 0.0064 0.0477 0.0947
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 0.0038 0.0173 0.0173
Brugia malayi beta-lactamase 0.011 0.1023 0.2032
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0138 0.1349 0.1349
Mycobacterium leprae possible long-chain acyl-CoA synthase 0.0428 0.4763 1
Brugia malayi RNA recognition motif domain containing protein 0.0064 0.0477 0.0947
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0038 0.0177 0.1725
Plasmodium falciparum ataxin-2 like protein, putative 0.0052 0.0336 1
Loa Loa (eye worm) hypothetical protein 0.003 0.0082 0.0162
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0211 0.2207 0.4382
Trichomonas vaginalis alpha-glucosidase, putative 0.0076 0.0615 0.241
Plasmodium falciparum flap endonuclease 1 0.0026 0.0035 0.1034
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0477 0.0625
Trichomonas vaginalis penicillin-binding protein, putative 0.011 0.1023 0.4013
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.011 0.1023 0.2032
Echinococcus granulosus histone lysine methyltransferase setb 0.003 0.0082 0.0107
Entamoeba histolytica ubiquitin carboxyl-terminal hydrolase domain containing protein 0.0038 0.0173 0.2822
Echinococcus multilocularis lysosomal alpha glucosidase 0.034 0.3731 0.3731
Loa Loa (eye worm) AMP-binding enzyme family protein 0.0451 0.5037 1
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0038 0.0177 0.5252
Echinococcus multilocularis GPCR, family 2 0.0032 0.0097 0.0097
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0032 0.0097 0.0193
Echinococcus multilocularis inositol monophosphatase 1 0.0038 0.0173 0.0173
Echinococcus granulosus beta LACTamase domain containing family member 0.011 0.1023 0.134
Trypanosoma brucei hypothetical protein, conserved 0.011 0.1023 1
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0076 0.0615 1
Trypanosoma cruzi PAB1-binding protein , putative 0.0052 0.0336 0.0696
Mycobacterium tuberculosis Probable esterase LipL 0.011 0.1023 0.1277
Echinococcus granulosus flap endonuclease 1 0.0026 0.0035 0.0045
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0138 0.1349 0.1767
Plasmodium falciparum ataxin-2 like protein, putative 0.0052 0.0336 1
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0477 0.0625
Brugia malayi beta-lactamase family protein 0.011 0.1023 0.2032
Mycobacterium tuberculosis Probable lipase LipE 0.011 0.1023 0.1277
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0038 0.0177 0.2873
Brugia malayi hypothetical protein 0.023 0.2436 0.4836
Mycobacterium tuberculosis Conserved protein 0.011 0.1023 0.1277
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0038 0.0173 0.1689
Trichomonas vaginalis alpha-glucosidase, putative 0.0076 0.0615 0.241
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0071 0.0559 0.0732
Onchocerca volvulus 0.003 0.0082 0.0321
Loa Loa (eye worm) pigment dispersing factor receptor c 0.01 0.0899 0.1785
Onchocerca volvulus 0.011 0.1023 0.4013
Echinococcus multilocularis beta LACTamase domain containing family member 0.011 0.1023 0.1023
Mycobacterium tuberculosis Conserved protein 0.011 0.1023 0.1277
Mycobacterium tuberculosis Probable conserved lipoprotein 0.011 0.1023 0.1277
Trichomonas vaginalis maltase-glucoamylase, putative 0.0028 0.0057 0.0223
Schistosoma mansoni inositol monophosphatase 0.0038 0.0173 0.0226
Brugia malayi hypothetical protein 0.0071 0.0559 0.1109
Mycobacterium ulcerans hypothetical protein 0.011 0.1023 0.2032
Trypanosoma brucei PAB1-binding protein , putative 0.0052 0.0336 0.3285
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0477 0.0625
Treponema pallidum exodeoxyribonuclease (exoA) 0.0038 0.0177 0.5
Brugia malayi exodeoxyribonuclease III family protein 0.0038 0.0177 0.035
Trypanosoma cruzi glycosyl hydrolase-like protein, putative 0.0028 0.0057 0.0118
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.003 0.0082 0.0799
Plasmodium vivax hypothetical protein, conserved 0.011 0.1023 1
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.011 0.1023 0.1277
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0038 0.0173 0.0358
Mycobacterium tuberculosis Conserved protein 0.011 0.1023 0.1277
Trichomonas vaginalis alpha-glucosidase, putative 0.0028 0.0057 0.0223
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) 0.0038 0.0173 0.0227
Loa Loa (eye worm) hypothetical protein 0.011 0.1023 0.2032
Trypanosoma brucei glucosidase, putative 0.0076 0.0615 0.6005
Trichomonas vaginalis alpha-glucosidase, putative 0.0076 0.0615 0.241
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0032 0.0097 0.0127
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0038 0.0173 0.0678
Trichomonas vaginalis conserved hypothetical protein 0.0038 0.0173 0.068
Trichomonas vaginalis alpha-glucosidase, putative 0.0076 0.0615 0.241
Leishmania major hypothetical protein, conserved 0.0052 0.0336 0.0706
Trichomonas vaginalis inositol monophosphatase, putative 0.0038 0.0173 0.0678
Trichomonas vaginalis ap endonuclease, putative 0.0038 0.0177 0.0692
Echinococcus multilocularis ubiquitin specific protease 41 0.0038 0.0173 0.0173
Schistosoma mansoni ap endonuclease 0.0038 0.0177 0.0231
Loa Loa (eye worm) hypothetical protein 0.0038 0.0173 0.0344
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.011 0.1023 0.2032
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.0034 0.0126 0.0157
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 0.0038 0.0173 0.9779
Onchocerca volvulus 0.024 0.255 1
Onchocerca volvulus 0.011 0.1023 0.4013
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0038 0.0173 0.068
Brugia malayi TAR-binding protein 0.0064 0.0477 0.0947
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0082 0.0107
Schistosoma mansoni FFA transport protein 0.0434 0.483 0.6324
Echinococcus multilocularis lysosomal alpha glucosidase 0.034 0.3731 0.3731
Echinococcus granulosus lysosomal alpha glucosidase 0.034 0.3731 0.4885
Echinococcus multilocularis flap endonuclease 1 0.0026 0.0035 0.0035
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0064 0.0477 0.0947
Loa Loa (eye worm) hypothetical protein 0.011 0.1023 0.2032
Trichomonas vaginalis alpha-glucosidase, putative 0.0028 0.0057 0.0223
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0704 0.8016 1
Schistosoma mansoni hypothetical protein 0.0047 0.0279 0.0365
Plasmodium vivax flap endonuclease 1, putative 0.0026 0.0035 0.0339
Brugia malayi Latrophilin receptor protein 2 0.0032 0.0097 0.0193
Schistosoma mansoni alpha-glucosidase 0.0293 0.3173 0.4155
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0032 0.0097 0.0127
Schistosoma mansoni alpha-glucosidase 0.0293 0.3173 0.4155
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.011 0.1023 0.134
Mycobacterium leprae Probable lipase LipE 0.011 0.1023 0.2149
Trichomonas vaginalis D-aminoacylase, putative 0.011 0.1023 0.4013
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0038 0.0173 0.0678
Schistosoma mansoni hypothetical protein 0.0071 0.0559 0.0732
Echinococcus granulosus tar DNA binding protein 0.0064 0.0477 0.0625
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.0279 0.0553
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0038 0.0173 0.0359
Entamoeba histolytica hypothetical protein 0.0071 0.0559 0.9091
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0082 0.0107
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.003 0.0082 0.0082
Trypanosoma cruzi hypothetical protein, conserved 0.011 0.1023 0.2119
Brugia malayi beta-lactamase family protein 0.011 0.1023 0.2032
Onchocerca volvulus 0.0047 0.0279 0.1093
Entamoeba histolytica hypothetical protein 0.0071 0.0559 0.9091
Schistosoma mansoni hypothetical protein 0.0068 0.0528 0.0691
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0038 0.0173 0.2813
Loa Loa (eye worm) latrophilin receptor protein 2 0.0032 0.0097 0.0193
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0138 0.1349 0.1349
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 0.0038 0.0173 0.0227
Trypanosoma cruzi hypothetical protein, conserved 0.011 0.1023 0.2119
Schistosoma mansoni alpha glucosidase 0.0076 0.0615 0.0805
Schistosoma mansoni hypothetical protein 0.0032 0.0097 0.0127
Echinococcus granulosus neutral alpha glucosidase AB 0.0076 0.0615 0.0805
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.011 0.1023 0.1277
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0477 0.0625
Brugia malayi hypothetical protein 0.0033 0.012 0.0238
Trichomonas vaginalis maltase-glucoamylase, putative 0.0076 0.0615 0.241
Leishmania major hypothetical protein, conserved 0.011 0.1023 0.2149
Trypanosoma cruzi glycosyl hydrolase-like protein, putative 0.0028 0.0057 0.0118
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0038 0.0177 0.035
Trichomonas vaginalis flap endonuclease-1, putative 0.0026 0.0035 0.0136
Schistosoma mansoni inositol monophosphatase 0.0038 0.0173 0.0226
Trichomonas vaginalis D-aminoacylase, putative 0.011 0.1023 0.4013
Trypanosoma cruzi hypothetical protein, conserved 0.0076 0.0615 0.1272
Trichomonas vaginalis sucrase-isomaltase, putative 0.0076 0.0615 0.241
Echinococcus multilocularis survival motor neuron protein 1 0.023 0.2436 0.2436
Schistosoma mansoni ap endonuclease 0.0038 0.0177 0.0231
Loa Loa (eye worm) inositol-1 0.0038 0.0173 0.0343
Mycobacterium leprae conserved hypothetical protein 0.011 0.1023 0.2149
Trichomonas vaginalis alpha-glucosidase, putative 0.0028 0.0057 0.0223
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0038 0.0177 1
Mycobacterium tuberculosis Probable hydrolase 0.011 0.1023 0.1277
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0034 0.0126 0.0265
Echinococcus granulosus GPCR family 2 0.0032 0.0097 0.0127
Mycobacterium ulcerans esterase/lipase LipP 0.011 0.1023 0.2032
Trypanosoma cruzi PAB1-binding protein , putative 0.0052 0.0336 0.0696
Trichomonas vaginalis D-aminoacylase, putative 0.011 0.1023 0.4013
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0038 0.0177 1
Echinococcus granulosus ubiquitin specific protease 41 0.0038 0.0173 0.0227
Leishmania major alpha glucosidase II subunit, putative 0.0076 0.0615 0.129
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0032 0.0097 0.0097
Trypanosoma brucei flap endonuclease-1 (FEN-1), putative 0.0026 0.0035 0.0339
Trichomonas vaginalis alpha-glucosidase, putative 0.0076 0.0615 0.241
Loa Loa (eye worm) hypothetical protein 0.0052 0.0336 0.0667
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0038 0.0177 0.0366
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0038 0.0173 0.1689
Mycobacterium ulcerans beta-lactamase 0.011 0.1023 0.2032
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0477 0.0625
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0138 0.1349 0.1767
Brugia malayi Glycosyl hydrolases family 31 protein 0.0076 0.0615 0.122
Entamoeba histolytica hypothetical protein 0.0071 0.0559 0.9091
Toxoplasma gondii LsmAD domain-containing protein 0.0052 0.0336 0.3285
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) 0.0038 0.0173 0.0227
Echinococcus multilocularis neutral alpha glucosidase AB 0.0076 0.0615 0.0615
Toxoplasma gondii exonuclease III APE 0.0038 0.0177 0.1725
Entamoeba histolytica Flap nuclease, putative 0.0026 0.0035 0.0565
Trypanosoma cruzi fatty acid transporter protein-like, putative 0.0434 0.483 1
Brugia malayi latrophilin 2 splice variant baaae 0.0068 0.0528 0.1048
Brugia malayi hypothetical protein 0.0052 0.0336 0.0667
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0082 0.0107
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative 0.0038 0.0173 0.1694
Brugia malayi Inositol-1 0.0038 0.0173 0.0343
Echinococcus multilocularis long chain fatty acid transport protein 4 0.0434 0.483 0.483
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0071 0.0559 0.0559
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0038 0.0177 0.0371
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0138 0.1349 0.1767
Trypanosoma cruzi hypothetical protein, conserved 0.0076 0.0615 0.1272
Echinococcus granulosus inositol monophosphatase 1 0.0038 0.0173 0.0226
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0038 0.0173 0.0343
Trypanosoma cruzi fatty acid transporter protein-like, putative 0.0434 0.483 1
Onchocerca volvulus 0.011 0.1023 0.4013
Brugia malayi Glycosyl hydrolases family 31 protein 0.0028 0.0057 0.0113
Brugia malayi Pre-SET motif family protein 0.0211 0.2207 0.4382
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0076 0.0615 0.122
Echinococcus granulosus survival motor neuron protein 1 0.023 0.2436 0.319
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.01 0.0899 0.1785
Leishmania major fatty acid transporter protein-like protein 0.0428 0.4763 1
Loa Loa (eye worm) hypothetical protein 0.01 0.0899 0.1785
Trypanosoma brucei glycosyl hydrolase-like protein 0.0028 0.0057 0.0555
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0038 0.0173 0.0358
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative 0.0038 0.0173 0.0364
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0038 0.0173 0.0359
Loa Loa (eye worm) beta-lactamase 0.011 0.1023 0.2032
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0076 0.0615 0.6005
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0038 0.0177 0.0231

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 1.8356 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in MCF 10a normal breast cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 4.1475 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) 4.4668 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860] ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference
Potency (functional) 100 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Rango (Ran-regulated importin-beta cargo) - Importin beta complex formation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID540273] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23
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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