Detailed information for compound 1122156

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 276.218 | Formula: C10H13FN2O6
  • H donors: 4 H acceptors: 5 LogP: -2.15 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC[C@H]1OC([C@@H]([C@@H]1O)O)n1c(CF)cc(=O)[nH]c1=O
  • InChi: 1S/C10H13FN2O6/c11-2-4-1-6(15)12-10(18)13(4)9-8(17)7(16)5(3-14)19-9/h1,5,7-9,14,16-17H,2-3H2,(H,12,15,18)/t5-,7-,8-,9?/m1/s1
  • InChiKey: CGECCUIXQTVCJP-HDPJAJKNSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
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 glucosylceramidase, putative 0.0178 0.0518 0.621
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0103 0.01
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.008 0.0797
Schistosoma mansoni jumonji/arid domain-containing protein 0.0041 0.009 0.0085
Schistosoma mansoni jumonji domain containing protein 0.0085 0.0226 0.0236
Echinococcus granulosus GPCR family 2 0.0066 0.0168 0.0172
Toxoplasma gondii ABC1 family protein 0.0038 0.008 0.1694
Loa Loa (eye worm) hypothetical protein 0.006 0.015 0.0961
Echinococcus granulosus beta LACTamase domain containing family member 0.0038 0.008 0.0074
Schistosoma mansoni jumonji/arid domain-containing protein 0.0041 0.009 0.0085
Mycobacterium tuberculosis Integral membrane indolylacetylinositol arabinosyltransferase EmbA (arabinosylindolylacetylinositol synthase) 0.3205 1 1
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0038 0.008 0.0065
Schistosoma mansoni cpg binding protein 0.0033 0.0063 0.0055
Mycobacterium leprae Probable integral membrane indolylacetylinositol arabinosyltransferase EmbC (arabinosylindolylacetylinositol synthase) 0.3205 1 1
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0065 0.0165 0.0168
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.0489 0.5858
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0038 0.008 0.0074
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0242 0.072 0.4987
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0103 0.01
Echinococcus granulosus survival motor neuron protein 1 0.0264 0.0789 0.0858
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0103 0.01
Brugia malayi cytoplasmic intermediate filament protein 0.0032 0.0062 0.0342
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0107 0.0295 0.0312
Echinococcus granulosus ferritin 0.0018 0.0016 0.0002
Toxoplasma gondii aldehyde dehydrogenase 0.0065 0.0165 1
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.0489 0.5858
Loa Loa (eye worm) hypothetical protein 0.0028 0.0048 0.0247
Brugia malayi Bromodomain containing protein 0.0033 0.0063 0.0348
Loa Loa (eye worm) hypothetical protein 0.0038 0.008 0.0471
Brugia malayi MH2 domain containing protein 0.0247 0.0735 0.5094
Schistosoma mansoni ferritin light chain 0.0018 0.0016 0.0002
Mycobacterium tuberculosis Probable hydrolase 0.0038 0.008 0.0065
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.008 0.0797
Onchocerca volvulus 0.0469 0.143 1
Onchocerca volvulus 0.006 0.015 0.0672
Schistosoma mansoni apoferritin-2 0.0018 0.0016 0.0002
Mycobacterium tuberculosis Conserved protein 0.0038 0.008 0.0065
Echinococcus granulosus geminin 0.0189 0.0554 0.0599
Echinococcus granulosus dnaJ subfamily B 0.0439 0.1337 0.1465
Trichomonas vaginalis glucosylceramidase, putative 0.0178 0.0518 0.621
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.021 0.0617 0.4262
Schistosoma mansoni hypothetical protein 0.0066 0.0168 0.0172
Mycobacterium ulcerans aldehyde dehydrogenase 0.0065 0.0165 0.015
Echinococcus multilocularis musashi 0.006 0.015 0.0151
Loa Loa (eye worm) intermediate filament protein 0.006 0.015 0.0961
Mycobacterium ulcerans hypothetical protein 0.0038 0.008 0.0065
Echinococcus multilocularis survival motor neuron protein 1 0.0264 0.0789 0.0858
Mycobacterium ulcerans integral membrane indolylacetylinositol arabinosyltransferase EmbC 0.3205 1 1
Plasmodium vivax SET domain protein, putative 0.0035 0.0071 0.8909
Trichomonas vaginalis glucosylceramidase, putative 0.0257 0.0766 0.9284
Mycobacterium leprae conserved hypothetical protein 0.0038 0.008 0.0065
Trichomonas vaginalis set domain proteins, putative 0.0276 0.0824 1
Echinococcus granulosus microtubule associated protein 2 0.2901 0.9048 1
Schistosoma mansoni intermediate filament proteins 0.006 0.015 0.0151
Trichomonas vaginalis conserved hypothetical protein 0.0185 0.0541 0.65
Brugia malayi jmjC domain containing protein 0.0107 0.0295 0.1989
Schistosoma mansoni lozenge 0.0059 0.0145 0.0146
Brugia malayi CXXC zinc finger family protein 0.0031 0.0057 0.031
Loa Loa (eye worm) runx1 0.0059 0.0145 0.0929
Mycobacterium tuberculosis Integral membrane indolylacetylinositol arabinosyltransferase EmbB (arabinosylindolylacetylinositol synthase) 0.3205 1 1
Mycobacterium ulcerans lipase LipD 0.0038 0.008 0.0065
Echinococcus multilocularis tar DNA binding protein 0.0067 0.0171 0.0174
Schistosoma mansoni tar DNA-binding protein 0.0067 0.0171 0.0174
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0035 0.0071 0.0064
Mycobacterium ulcerans beta-lactamase 0.0038 0.008 0.0065
Echinococcus granulosus PHD finger protein rhinoceros 0.0033 0.0063 0.0055
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0035 0.0071 0.0064
Loa Loa (eye worm) hypothetical protein 0.0029 0.0052 0.0271
Loa Loa (eye worm) hypothetical protein 0.0469 0.143 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0038 0.008 0.0074
Brugia malayi hypothetical protein 0.0264 0.0789 0.5475
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0046 0.0103 0.0635
Schistosoma mansoni hypothetical protein 0.0066 0.0168 0.0172
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0103 0.01
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0066 0.0168 0.0172
Onchocerca volvulus 0.0276 0.0824 0.5588
Mycobacterium tuberculosis Probable lipase LipD 0.0038 0.008 0.0065
Brugia malayi TAR-binding protein 0.0067 0.0171 0.1111
Echinococcus granulosus lamin dm0 0.006 0.015 0.0151
Loa Loa (eye worm) latrophilin receptor protein 2 0.0066 0.0168 0.1094
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0038 0.008 0.0065
Schistosoma mansoni hypothetical protein 0.0439 0.1337 0.1465
Loa Loa (eye worm) hypothetical protein 0.0038 0.008 0.0471
Trichomonas vaginalis penicillin-binding protein, putative 0.0038 0.008 0.0797
Schistosoma mansoni lamin 0.006 0.015 0.0151
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.0489 0.5858
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0038 0.008 0.0471
Schistosoma mansoni microtubule-associated protein tau 0.2901 0.9048 1
Loa Loa (eye worm) TAR-binding protein 0.0067 0.0171 0.1111
Schistosoma mansoni ferritin 0.0018 0.0016 0.0002
Brugia malayi F/Y-rich N-terminus family protein 0.0021 0.0028 0.01
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0065 0.0165 1
Loa Loa (eye worm) PHD-finger family protein 0.0033 0.0063 0.0348
Trichomonas vaginalis glucosylceramidase, putative 0.0257 0.0766 0.9284
Brugia malayi beta-lactamase 0.0038 0.008 0.0471
Toxoplasma gondii histone lysine methyltransferase SET1 0.006 0.0148 0.8314
Mycobacterium tuberculosis Conserved protein 0.0038 0.008 0.0065
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0103 0.01
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0038 0.008 0.0065
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0035 0.0071 0.0839
Schistosoma mansoni tar DNA-binding protein 0.0067 0.0171 0.0174
Giardia lamblia PHD finger protein 15 0.0033 0.0063 0.5
Mycobacterium ulcerans aldehyde dehydrogenase 0.0065 0.0165 0.015
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0035 0.0071 0.0064
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0107 0.0295 0.0312
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0035 0.0071 0.0064
Brugia malayi Voltage-gated calcium channel, T-type, alpha subunit. C. elegans cca-1 ortholog 0.0191 0.0558 0.3842
Schistosoma mansoni hypothetical protein 0.0143 0.0409 0.0438
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.008 0.5
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0035 0.0071 0.0064
Echinococcus multilocularis GPCR, family 2 0.0066 0.0168 0.0172
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.006 0.015 0.0961
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0038 0.008 0.0471
Schistosoma mansoni hypothetical protein 0.0189 0.0554 0.0599
Plasmodium vivax hypothetical protein, conserved 0.0033 0.0063 0.784
Onchocerca volvulus 0.0054 0.013 0.0527
Echinococcus granulosus lysine specific demethylase 5A 0.0041 0.009 0.0085
Onchocerca volvulus Alhambra homolog 0.0033 0.0063 0.004
Brugia malayi beta-lactamase family protein 0.0038 0.008 0.0471
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0035 0.0071 0.0064
Schistosoma mansoni ferritin light chain 0.0018 0.0016 0.0002
Mycobacterium leprae Probable integral membrane indolylacetylinositol arabinosyltransferase EmbB (arabinosylindolylacetylinositol synthase) 0.3205 1 1
Loa Loa (eye worm) hypothetical protein 0.0143 0.0409 0.2796
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.0257 0.0766 0.5316
Schistosoma mansoni tar DNA-binding protein 0.0067 0.0171 0.0174
Trichomonas vaginalis glucosylceramidase, putative 0.0257 0.0766 0.9284
Onchocerca volvulus 0.0038 0.008 0.0166
Brugia malayi PHD-finger family protein 0.0033 0.0063 0.0348
Echinococcus multilocularis ferritin 0.0018 0.0016 0.0002
Echinococcus multilocularis expressed protein 0.0018 0.0016 0.0002
Mycobacterium ulcerans integral membrane indolylacetylinositol arabinosyltransferase EmbB 0.3205 1 1
Brugia malayi Pre-SET motif family protein 0.0242 0.072 0.4987
Echinococcus multilocularis dnaJ subfamily B 0.0439 0.1337 0.1465
Loa Loa (eye worm) hypothetical protein 0.0191 0.0558 0.3842
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.0489 0.5858
Schistosoma mansoni aldehyde dehydrogenase 0.0065 0.0165 0.0168
Mycobacterium tuberculosis Probable lipase LipE 0.0038 0.008 0.0065
Plasmodium vivax hypothetical protein, conserved 0.0038 0.008 1
Brugia malayi RNA binding protein 0.0067 0.0171 0.1111
Loa Loa (eye worm) hypothetical protein 0.0035 0.0071 0.0409
Onchocerca volvulus 0.0035 0.0071 0.0102
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0067 0.0171 0.1111
Loa Loa (eye worm) hypothetical protein 0.0469 0.143 1
Loa Loa (eye worm) hypothetical protein 0.0028 0.0048 0.0247
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0067 0.017 0.0173
Schistosoma mansoni aldehyde dehydrogenase 0.0065 0.0165 0.0168
Onchocerca volvulus Glucosylceramidase homolog 0.0169 0.0489 0.3148
Onchocerca volvulus 0.006 0.015 0.0672
Schistosoma mansoni lamin 0.006 0.015 0.0151
Brugia malayi latrophilin 2 splice variant baaae 0.0143 0.0409 0.2796
Schistosoma mansoni hypothetical protein 0.0054 0.013 0.0129
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.0489 0.5858
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0066 0.0168 0.0172
Mycobacterium ulcerans aldehyde dehydrogenase 0.0065 0.0165 0.015
Brugia malayi RNA recognition motif domain containing protein 0.0067 0.0171 0.1111
Plasmodium falciparum phd finger protein, putative 0.0033 0.0063 1
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0029 0.0052 0.0042
Onchocerca volvulus 0.0038 0.008 0.0166
Schistosoma mansoni survival motor neuron protein 0.0054 0.013 0.0129
Trichomonas vaginalis esterase, putative 0.0038 0.008 0.0797
Brugia malayi intermediate filament protein 0.006 0.015 0.0961
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0244 0.0724 0.0709
Trichomonas vaginalis glucosylceramidase, putative 0.0257 0.0766 0.9284
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.008 0.5
Loa Loa (eye worm) jmjC domain-containing protein 0.0067 0.0172 0.1116
Mycobacterium leprae Probable lipase LipE 0.0038 0.008 0.0065
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0033 0.0063 0.0055
Brugia malayi Calcitonin receptor-like protein seb-1 0.021 0.0617 0.4262
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0054 0.013 0.082
Wolbachia endosymbiont of Brugia malayi bacterioferritin/cytochrome b1 0.0018 0.0016 0.5
Loa Loa (eye worm) hypothetical protein 0.0033 0.0063 0.0348
Brugia malayi beta-lactamase family protein 0.0038 0.008 0.0471
Schistosoma mansoni cpg binding protein 0.0031 0.0057 0.0049
Echinococcus multilocularis microtubule associated protein 2 0.2901 0.9048 1
Schistosoma mansoni hypothetical protein 0.0189 0.0554 0.0599
Echinococcus granulosus tar DNA binding protein 0.0067 0.0171 0.0174
Echinococcus multilocularis lysine specific demethylase 5A 0.0039 0.0084 0.0078
Loa Loa (eye worm) hypothetical protein 0.0038 0.008 0.0471
Loa Loa (eye worm) jmjC domain-containing protein 0.0041 0.009 0.0539
Schistosoma mansoni apoferritin-2 0.0018 0.0016 0.0002
Loa Loa (eye worm) beta-lactamase 0.0038 0.008 0.0471
Loa Loa (eye worm) hypothetical protein 0.0056 0.0136 0.0863
Loa Loa (eye worm) hypothetical protein 0.021 0.0617 0.4262
Echinococcus multilocularis cpg binding protein 0.0033 0.0063 0.0055
Schistosoma mansoni hypothetical protein 0.0066 0.0168 0.0172
Schistosoma mansoni hypothetical protein 0.0066 0.0168 0.0172
Echinococcus granulosus intermediate filament protein 0.006 0.015 0.0151
Schistosoma mansoni hypothetical protein 0.0033 0.0063 0.0055
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.0489 0.5858
Echinococcus multilocularis jumonji domain containing protein 0.0045 0.0103 0.0099
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.0489 0.5858
Mycobacterium tuberculosis Conserved protein 0.0038 0.008 0.0065
Brugia malayi Pre-SET motif family protein 0.0035 0.0071 0.0409
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0065 0.0165 0.0168
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0046 0.0103 0.0635
Loa Loa (eye worm) hypothetical protein 0.0264 0.0789 0.5475
Loa Loa (eye worm) transcription factor SMAD2 0.0247 0.0735 0.5094
Echinococcus granulosus jumonji domain containing protein 0.0045 0.0103 0.0099
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0065 0.0165 0.015
Loa Loa (eye worm) RNA binding protein 0.0067 0.0171 0.1111
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0103 0.01
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0066 0.0168 0.0172
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.0257 0.0766 0.5316
Brugia malayi jmjC domain containing protein 0.0041 0.009 0.0539
Loa Loa (eye worm) hypothetical protein 0.0059 0.0146 0.0936
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.008 0.0797
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0038 0.008 0.0065
Echinococcus granulosus cpg binding protein 0.0033 0.0063 0.0055
Trichomonas vaginalis penicillin-binding protein, putative 0.0038 0.008 0.0797
Loa Loa (eye worm) CXXC zinc finger family protein 0.0031 0.0057 0.031
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0033 0.0065 0.0057
Mycobacterium tuberculosis Probable esterase LipL 0.0038 0.008 0.0065
Mycobacterium ulcerans esterase/lipase LipP 0.0038 0.008 0.0065
Echinococcus granulosus expressed protein 0.0018 0.0016 0.0002
Echinococcus granulosus histone lysine methyltransferase setb 0.0035 0.0071 0.0064
Onchocerca volvulus 0.0038 0.008 0.0166
Treponema pallidum bacterioferrin (TpF1) 0.0018 0.0016 0.5
Schistosoma mansoni tar DNA-binding protein 0.0067 0.0171 0.0174
Trypanosoma brucei hypothetical protein, conserved 0.0038 0.008 0.5
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0066 0.0168 0.1094
Mycobacterium tuberculosis Integral membrane indolylacetylinositol arabinosyltransferase EmbC (arabinosylindolylacetylinositol synthase) 0.3205 1 1
Trichomonas vaginalis glucosylceramidase, putative 0.0257 0.0766 0.9284
Schistosoma mansoni ferritin 0.0018 0.0016 0.0002
Echinococcus multilocularis peregrin 0.0033 0.0063 0.0055
Loa Loa (eye worm) hypothetical protein 0.0066 0.0168 0.1094
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0066 0.0168 0.0172
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0029 0.0052 0.0042
Echinococcus multilocularis lamin dm0 0.006 0.015 0.0151
Schistosoma mansoni hypothetical protein 0.006 0.0149 0.015
Brugia malayi Latrophilin receptor protein 2 0.0066 0.0168 0.1094
Echinococcus granulosus lamin 0.006 0.015 0.0151
Loa Loa (eye worm) hypothetical protein 0.0038 0.008 0.0471
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0103 0.01
Loa Loa (eye worm) MH2 domain-containing protein 0.0247 0.0735 0.5094
Echinococcus multilocularis PHD finger protein rhinoceros 0.0033 0.0063 0.0055
Schistosoma mansoni tar DNA-binding protein 0.0067 0.0171 0.0174
Trichomonas vaginalis glucosylceramidase, putative 0.0257 0.0766 0.9284
Mycobacterium ulcerans integral membrane indolylacetylinositol arabinosyltransferase EmbA 0.3205 1 1
Brugia malayi hypothetical protein 0.0469 0.143 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.021 0.0617 0.4262
Schistosoma mansoni cpg binding protein 0.0033 0.0063 0.0055
Loa Loa (eye worm) hypothetical protein 0.0038 0.008 0.0471
Loa Loa (eye worm) hypothetical protein 0.0038 0.008 0.0471
Schistosoma mansoni ferritin 0.0018 0.0016 0.0002
Echinococcus multilocularis lamin 0.006 0.015 0.0151
Brugia malayi Intermediate filament tail domain containing protein 0.006 0.015 0.0961
Schistosoma mansoni ferritin 0.0018 0.0016 0.0002
Echinococcus granulosus peregrin 0.0033 0.0063 0.0055
Echinococcus multilocularis Protein lozenge 0.0059 0.0145 0.0146
Echinococcus multilocularis geminin 0.0189 0.0554 0.0599
Schistosoma mansoni mixed-lineage leukemia protein mll 0.002 0.0022 0.001
Echinococcus multilocularis beta LACTamase domain containing family member 0.0038 0.008 0.0074
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0032 0.0062 0.0342

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) = 9.9 ug ml-1 In vitro anitumour activity of the compound was determined in IM-9 cell lines ChEMBL. 8648611
IC50 (functional) > 10 ug ml-1 In vitro anitumour activity of the compound was determined in MOLT-3 cell lines ChEMBL. 8648611
IC50 (functional) > 10 ug ml-1 In vitro anitumour activity of the compound was determined in U-937 cell lines ChEMBL. 8648611
IC50 (functional) > 10 ug ml-1 In vitro anitumour activity of the compound was determined in K-562 cell lines ChEMBL. 8648611
IC50 (functional) > 10 ug ml-1 IIn vitro anitumour activity of the compound was determined in PHA-Ly cell lines ChEMBL. 8648611

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23 8648611

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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