Detailed information for compound 302341

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 451.854 | Formula: C21H22ClNO8
  • H donors: 5 H acceptors: 6 LogP: 1.11 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC[C@H]1O[C@@H](NCC(=O)Oc2ccc(cc2)C(=O)c2ccccc2Cl)[C@@H]([C@H]([C@@H]1O)O)O
  • InChi: 1S/C21H22ClNO8/c22-14-4-2-1-3-13(14)17(26)11-5-7-12(8-6-11)30-16(25)9-23-21-20(29)19(28)18(27)15(10-24)31-21/h1-8,15,18-21,23-24,27-29H,9-10H2/t15-,18-,19+,20-,21-/m1/s1
  • InChiKey: DDDVRJXFDDFYDN-CMWLGVBASA-N  


Substructure search Similarity search

Network

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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
Loa Loa (eye worm) CXXC zinc finger family protein 0.0033 0.1572 0.1897
Echinococcus multilocularis lysosomal alpha glucosidase 0.0132 0.7873 0.7873
Schistosoma mansoni alpha-glucosidase 0.0114 0.6705 0.6705
Trypanosoma cruzi glycosyl hydrolase-like protein, putative 0.0011 0.0174 0.0628
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0027 0.1207 1
Echinococcus granulosus copper transporting ATPase 1 0.001 0.0096 0.0096
Echinococcus multilocularis calcium transporting ATPase type 2C member 0.001 0.0096 0.0096
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0022 0.0886 0.0886
Trichomonas vaginalis alpha-glucosidase, putative 0.0029 0.1343 1
Echinococcus multilocularis phosphoserine phosphatase 0.001 0.0096 0.0096
Brugia malayi CXXC zinc finger family protein 0.0033 0.1572 0.1897
Mycobacterium ulcerans acyl-CoA synthetase 0.0027 0.1207 1
Mycobacterium ulcerans acyl-CoA synthetase 0.0027 0.1207 1
Mycobacterium ulcerans DNA polymerase IV 0.0022 0.0886 0.711
Schistosoma mansoni cpg binding protein 0.0033 0.1572 0.1572
Entamoeba histolytica acyl-coA synthetase, putative 0.0027 0.1207 0.8908
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.001 0.0127 0.0127
Loa Loa (eye worm) bromodomain containing protein 0.0016 0.053 0.0558
Loa Loa (eye worm) hypothetical protein 0.002 0.077 0.0867
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0017 0.0539 0.0539
Trichomonas vaginalis maltase-glucoamylase, putative 0.0011 0.0174 0.0628
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0029 0.1343 1
Brugia malayi Glycosyl hydrolases family 31 protein 0.0132 0.7873 1
Echinococcus granulosus fetal alzheimer antigen falz 0.0023 0.0939 0.0939
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0043 0.2198 0.2198
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0019 0.07 0.5437
Echinococcus granulosus zinc finger protein 0.002 0.0763 0.0763
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0886 0.6333
Brugia malayi Glycosyl hydrolases family 31 protein 0.0029 0.1343 0.1603
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0018 0.0598 0.0598
Leishmania major 4-coumarate:coa ligase-like protein 0.0027 0.1207 0.8908
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0018 0.0598 0.0645
Schistosoma mansoni DNA polymerase eta 0.0022 0.0886 0.0886
Schistosoma mansoni copper ABC transporter ATPase 0.001 0.0096 0.0096
Loa Loa (eye worm) histone methyltransferase 0.001 0.0127 0.0041
Brugia malayi ImpB/MucB/SamB family protein 0.0022 0.0886 0.1015
Mycobacterium ulcerans fatty-acid-CoA ligase 0.002 0.077 0.6072
Mycobacterium ulcerans DNA polymerase IV 0.0022 0.0886 0.711
Echinococcus multilocularis cation transporting ATPase 13A1 0.001 0.0096 0.0096
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0027 0.1207 1
Trichomonas vaginalis ap endonuclease, putative 0.0018 0.0598 0.4025
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0886 0.6333
Trypanosoma brucei DNA polymerase IV, putative 0.0022 0.0886 0.6333
Trypanosoma cruzi glycosyl hydrolase-like protein, putative 0.0011 0.0174 0.0628
Schistosoma mansoni cation-transporting atpase worm 0.001 0.0096 0.0096
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0029 0.1343 0.3576
Leishmania major hypothetical protein, conserved 0.0014 0.0389 0.2354
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0018 0.0598 0.4519
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0029 0.1343 1
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.002 0.077 0.6072
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0027 0.1207 1
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0022 0.0886 0.6333
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0023 0.0939 0.0939
Echinococcus multilocularis phosphoserine phosphatase 0.001 0.0096 0.0096
Schistosoma mansoni cpg binding protein 0.0037 0.1804 0.1804
Loa Loa (eye worm) hypothetical protein 0.002 0.077 0.0867
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0886 0.6333
Echinococcus multilocularis phosphoserine phosphatase 0.001 0.0096 0.0096
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0034 0.1615 0.1615
Mycobacterium ulcerans acyl-CoA synthetase 0.0027 0.1207 1
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.002 0.077 1
Trichomonas vaginalis alpha-glucosidase, putative 0.0011 0.0174 0.0628
Brugia malayi AMP-binding enzyme family protein 0.0027 0.1207 0.1428
Trichomonas vaginalis maltase-glucoamylase, putative 0.0029 0.1343 1
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0018 0.0598 0.0598
Trypanosoma brucei glucosidase, putative 0.0029 0.1343 1
Echinococcus multilocularis phosphoserine phosphatase 0.001 0.0096 0.0096
Schistosoma mansoni hypothetical protein 0.0165 1 1
Trypanosoma brucei glycosyl hydrolase-like protein 0.0011 0.0174 0.0628
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0132 0.7873 1
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0058 0.3147 0.3147
Trichomonas vaginalis alpha-glucosidase, putative 0.0029 0.1343 1
Brugia malayi AMP-binding enzyme family protein 0.0027 0.1207 0.1428
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0027 0.1207 1
Schistosoma mansoni ATPase 0.001 0.0096 0.0096
Trichomonas vaginalis alpha-glucosidase, putative 0.0011 0.0174 0.0628
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0018 0.0598 0.5
Schistosoma mansoni mixed-lineage leukemia protein mll 0.007 0.3916 0.3916
Onchocerca volvulus 0.0076 0.4335 1
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0017 0.0539 0.0539
Echinococcus granulosus dna polymerase kappa 0.0022 0.0886 0.0886
Trypanosoma cruzi DNA polymerase kappa, putative 0.0022 0.0886 0.6333
Leishmania major alpha glucosidase II subunit, putative 0.0029 0.1343 1
Schistosoma mansoni zinc finger protein 0.002 0.0763 0.0763
Trichomonas vaginalis alpha-glucosidase, putative 0.0029 0.1343 1
Schistosoma mansoni type V p-type atpase isoform 0.001 0.0096 0.0096
Loa Loa (eye worm) hypothetical protein 0.002 0.077 0.0867
Trichomonas vaginalis alpha-glucosidase, putative 0.0011 0.0174 0.0628
Schistosoma mansoni methyl-cpg binding protein mbd 0.0016 0.0494 0.0494
Schistosoma mansoni alpha glucosidase 0.0029 0.1343 0.1343
Echinococcus multilocularis dna polymerase eta 0.0022 0.0886 0.0886
Brugia malayi Glycosyl hydrolases family 31 protein 0.0011 0.0174 0.0101
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0011 0.0174 0.0628
Echinococcus multilocularis cation transporting atpase worm 0.001 0.0096 0.0096
Echinococcus granulosus neutral alpha glucosidase AB 0.0029 0.1343 0.1343
Leishmania major glycosyl hydrolase-like protein 0.0011 0.0174 0.0628
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0019 0.07 0.5437
Echinococcus granulosus calcium transporting ATPase type 2C member 0.001 0.0096 0.0096
Echinococcus granulosus phospholipid transporting ATPase IIB 0.001 0.0096 0.0096
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0043 0.2198 0.2703
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0043 0.2198 0.2703
Brugia malayi exodeoxyribonuclease III family protein 0.0018 0.0598 0.0645
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0017 0.0539 0.0539
Schistosoma mansoni alpha-glucosidase 0.0114 0.6705 0.6705
Leishmania major 4-coumarate:coa ligase-like protein 0.0027 0.1207 0.8908
Trypanosoma cruzi hypothetical protein, conserved 0.0029 0.1343 1
Brugia malayi Bromodomain containing protein 0.0036 0.1756 0.2134
Trichomonas vaginalis alpha-glucosidase, putative 0.0011 0.0174 0.0628
Brugia malayi AMP-binding enzyme family protein 0.0027 0.1207 0.1428
Trypanosoma brucei DNA polymerase IV, putative 0.0022 0.0886 0.6333
Trypanosoma cruzi ISWI complex protein 0.0014 0.0389 0.2354
Loa Loa (eye worm) hypothetical protein 0.0101 0.5897 0.7458
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0019 0.07 0.5437
Loa Loa (eye worm) hypothetical protein 0.0027 0.1207 0.1428
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0886 0.6333
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0058 0.3147 0.3147
Echinococcus multilocularis phosphoserine phosphatase 0.001 0.0096 0.0096
Giardia lamblia DINP protein human, muc B family 0.0022 0.0886 1
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0018 0.0598 0.4025
Echinococcus multilocularis cpg binding protein 0.0037 0.1804 0.1804
Brugia malayi ImpB/MucB/SamB family protein 0.0022 0.0886 0.1015
Echinococcus granulosus cation transporting atpase worm 0.001 0.0096 0.0096
Schistosoma mansoni ap endonuclease 0.0018 0.0598 0.0598
Mycobacterium tuberculosis Conserved hypothetical protein 0.0022 0.0886 0.711
Loa Loa (eye worm) hypothetical protein 0.0017 0.0539 0.057
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0043 0.2198 0.2198
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0027 0.1207 1
Echinococcus multilocularis phospholipid transporting ATPase IIB 0.001 0.0096 0.0096
Loa Loa (eye worm) hypothetical protein 0.0027 0.1207 0.1428
Echinococcus multilocularis neutral alpha glucosidase AB 0.0029 0.1343 0.1343
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0011 0.0174 0.0628
Loa Loa (eye worm) hypothetical protein 0.0027 0.1207 0.1428
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0029 0.1343 1
Schistosoma mansoni Na+/K+ transporting ATPase subunit alpha 0.001 0.0096 0.0096
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0022 0.0886 0.711
Trypanosoma cruzi DNA polymerase kappa, putative 0.0022 0.0886 0.6333
Trypanosoma cruzi DNA polymerase kappa, putative 0.0022 0.0886 0.6333
Schistosoma mansoni hypothetical protein 0.0014 0.0389 0.0389
Plasmodium vivax acyl-CoA synthetase, putative 0.002 0.077 1
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0018 0.0598 0.4025
Trypanosoma brucei DNA polymerase eta, putative 0.0022 0.0886 0.6333
Entamoeba histolytica deoxycytidyl transferase, putative 0.0022 0.0886 0.6333
Echinococcus granulosus sarco:endoplasmic reticulum calcium ATPase 0.001 0.0096 0.0096
Schistosoma mansoni atpase class VI type 11c 0.001 0.0096 0.0096
Loa Loa (eye worm) hypothetical protein 0.0011 0.0174 0.0101
Echinococcus granulosus phospholipid transporting ATPase VA 0.001 0.0096 0.0096
Trypanosoma brucei DNA polymerase kappa, putative 0.0015 0.045 0.2836
Schistosoma mansoni bromodomain containing protein 0.0061 0.3359 0.3359
Echinococcus multilocularis dna polymerase kappa 0.0022 0.0886 0.0886
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0886 0.6333
Echinococcus multilocularis copper transporting ATPase 1 0.001 0.0096 0.0096
Loa Loa (eye worm) hypothetical protein 0.0036 0.176 0.214
Echinococcus granulosus histone lysine methyltransferase setb 0.0017 0.0539 0.0539
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0043 0.2198 0.2198
Loa Loa (eye worm) PHD-finger family protein 0.0019 0.0706 0.0785
Trypanosoma brucei DNA polymerase IV, putative 0.0022 0.0886 0.6333
Toxoplasma gondii histone lysine methyltransferase SET1 0.0064 0.3583 1
Schistosoma mansoni cation-transporting ATPase 0.001 0.0096 0.0096
Schistosoma mansoni cation-transporting atpase 13a1 (G-box binding protein) 0.001 0.0096 0.0096
Schistosoma mansoni cpg binding protein 0.0037 0.1804 0.1804
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0886 0.6333
Schistosoma mansoni cation-transporting atpase worm 0.001 0.0096 0.0096
Schistosoma mansoni hypothetical protein 0.0165 1 1
Brugia malayi F/Y-rich N-terminus family protein 0.0012 0.0233 0.0176
Leishmania major DNA polymerase kappa, putative 0.0022 0.0886 0.6333
Echinococcus granulosus plasma membrane calcium transporting ATPase 2 0.001 0.0096 0.0096
Trypanosoma cruzi DNA polymerase eta, putative 0.0022 0.0886 0.6333
Echinococcus multilocularis cation transporting ATPase 13A3 0.001 0.0096 0.0096
Trichomonas vaginalis DNA polymerase eta, putative 0.0022 0.0886 0.6333
Echinococcus granulosus methyl CpG binding domain protein 2 0.0016 0.0494 0.0494
Echinococcus multilocularis Tetracycline resistance leader peptide, TetL 0.001 0.0096 0.0096
Trichomonas vaginalis alpha-glucosidase, putative 0.0029 0.1343 1
Loa Loa (eye worm) hypothetical protein 0.0022 0.0886 0.1015
Leishmania major DNA polymerase eta, putative 0.0022 0.0886 0.6333
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0022 0.0886 0.6333
Trypanosoma brucei unspecified product 0.0015 0.045 0.2836
Plasmodium falciparum acyl-CoA synthetase 0.002 0.077 1
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.001 0.0127 0.0127
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0027 0.1207 1
Echinococcus multilocularis phospholipid transporting ATPase VA 0.001 0.0096 0.0096
Onchocerca volvulus 0.0027 0.1207 0.2621
Echinococcus multilocularis lysosomal alpha glucosidase 0.0132 0.7873 0.7873
Trypanosoma brucei ISWI complex protein 0.0014 0.0389 0.2354
Trichomonas vaginalis alpha-glucosidase, putative 0.0029 0.1343 1
Trichomonas vaginalis alpha-glucosidase, putative 0.0011 0.0174 0.0628
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0029 0.1343 1
Echinococcus multilocularis zinc finger protein 0.002 0.0763 0.0763
Brugia malayi hypothetical protein 0.0101 0.5897 0.7458
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0016 0.0494 0.0494
Trypanosoma brucei DNA polymerase kappa, putative 0.0015 0.045 0.2836
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0027 0.1207 1
Schistosoma mansoni phosphoserine phosphatase 0.001 0.0096 0.0096
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0018 0.0598 0.4519
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0022 0.0886 0.1015
Loa Loa (eye worm) hypothetical protein 0.0101 0.5897 0.7458
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0043 0.2198 0.2198
Echinococcus multilocularis sarco:endoplasmic reticulum calcium ATPase 0.001 0.0096 0.0096
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0043 0.2198 0.2198
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0019 0.07 0.5437
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0043 0.2198 0.2198
Trypanosoma cruzi ISWI complex protein 0.0014 0.0389 0.2354
Loa Loa (eye worm) hypothetical protein 0.0042 0.2134 0.262
Trypanosoma brucei unspecified product 0.0015 0.045 0.2836
Loa Loa (eye worm) hypothetical protein 0.002 0.077 0.0867
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0018 0.0598 0.4025
Trypanosoma brucei DNA polymerase kappa, putative 0.0015 0.045 0.2836
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0018 0.0598 0.7443
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0022 0.0886 0.0886
Echinococcus granulosus cation transporting ATPase 13A1 0.001 0.0096 0.0096
Brugia malayi PHD-finger family protein 0.0025 0.108 0.1265
Echinococcus granulosus dna polymerase eta 0.0022 0.0886 0.0886
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0043 0.2198 0.2198
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0886 0.6333
Loa Loa (eye worm) hypothetical protein 0.002 0.077 0.0867
Trypanosoma cruzi DNA polymerase kappa, putative 0.0022 0.0886 0.6333
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0022 0.0886 0.0886
Schistosoma mansoni terminal deoxycytidyl transferase 0.0022 0.0886 0.0886
Trypanosoma cruzi hypothetical protein, conserved 0.0029 0.1343 1
Mycobacterium ulcerans hypothetical protein 0.0027 0.1207 1
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0027 0.1207 1
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0029 0.1343 0.1603
Leishmania major 4-coumarate:coa ligase-like protein 0.0027 0.1207 0.8908
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0011 0.0174 0.0628
Toxoplasma gondii exonuclease III APE 0.0018 0.0598 0.144
Loa Loa (eye worm) hypothetical protein 0.0038 0.1901 0.2321
Schistosoma mansoni eyes absent homolog 0.0101 0.5897 0.5897
Schistosoma mansoni zinc finger protein 0.0014 0.0389 0.0389
Onchocerca volvulus 0.0033 0.1572 0.3481
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0886 0.6333
Loa Loa (eye worm) hypothetical protein 0.0066 0.3682 0.4611
Echinococcus granulosus cpg binding protein 0.0037 0.1804 0.1804
Echinococcus granulosus lysosomal alpha glucosidase 0.0132 0.7873 0.7873
Onchocerca volvulus Uncharacterized family 31 glucosidase KIAA1161 homolog 0.0011 0.0174 0.0185
Echinococcus granulosus cation transporting ATPase 13A3 0.001 0.0096 0.0096
Echinococcus multilocularis phosphoserine phosphatase 0.001 0.0096 0.0096
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0886 0.6333
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0018 0.0598 0.6356
Schistosoma mansoni ATPase 0.001 0.0096 0.0096
Schistosoma mansoni hypothetical protein 0.0019 0.0706 0.0706
Trichomonas vaginalis ap endonuclease, putative 0.0018 0.0598 0.4025
Entamoeba histolytica acyl-CoA synthetase, putative 0.0027 0.1207 0.8908
Echinococcus multilocularis geminin 0.0165 1 1
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0018 0.0598 0.4025
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0886 0.6333
Entamoeba histolytica acyl-CoA synthetase, putative 0.0027 0.1207 0.8908
Trichomonas vaginalis sucrase-isomaltase, putative 0.0029 0.1343 1
Trypanosoma brucei unspecified product 0.0022 0.0886 0.6333
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0023 0.0939 0.0939
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0018 0.0598 0.7443
Schistosoma mansoni ap endonuclease 0.0018 0.0598 0.0598
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0018 0.0598 0.4025
Treponema pallidum exodeoxyribonuclease (exoA) 0.0018 0.0598 1
Brugia malayi Bromodomain containing protein 0.0072 0.4056 0.5091
Schistosoma mansoni methyl-cpg binding protein mbd 0.0016 0.0494 0.0494
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0034 0.1615 0.1615

Activities

Activity type Activity value Assay description Source Reference
Activity (functional) = 20 % Percentage reduction of thrombus formation by weight in rat (intraperitoneal administration) ChEMBL. 8464044
LD0 (functional) > 800 mg Antithrombotic activity was determined at 100 mg/kg for nonlethal dose in rat ChEMBL. 8464044

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

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

1 literature reference was collected for this gene.

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