Detailed information for compound 1330481

Basic information

Technical information
  • TDR Targets ID: 1330481
  • Name: N-(5-chloropyridin-2-yl)-2,4,6-trimethylbenze nesulfonamide
  • MW: 310.799 | Formula: C14H15ClN2O2S
  • H donors: 1 H acceptors: 3 LogP: 3.43 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1cc(C)c(c(c1)C)S(=O)(=O)Nc1ccc(cn1)Cl
  • InChi: 1S/C14H15ClN2O2S/c1-9-6-10(2)14(11(3)7-9)20(18,19)17-13-5-4-12(15)8-16-13/h4-8H,1-3H3,(H,16,17)
  • InChiKey: XZUJJEKUEVIAIW-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-(5-chloro-2-pyridyl)-2,4,6-trimethyl-benzenesulfonamide
  • N-(5-chloro-2-pyridyl)-2,4,6-trimethylbenzenesulfonamide
  • N-(5-chloropyridin-2-yl)-2,4,6-trimethyl-benzenesulfonamide
  • MLS001203400
  • SMR000517186
  • ZINC00303921
  • EU-0071760
  • ST5258202
  • BAS 01936588
  • N-(5-Chloro-pyridin-2-yl)-2,4,6-trimethyl-benzenesulfonamide
  • AG-690/15437285

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens lysine (K)-specific methyltransferase 2A Starlite/ChEMBL No references
Homo sapiens SMAD family member 2 Starlite/ChEMBL No references
Homo sapiens glucagon-like peptide 1 receptor Starlite/ChEMBL No references
Homo sapiens multiple endocrine neoplasia I No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Neospora caninum Multidomain chromatinic protein with the following architecture: 3x PHD-bromo-3xPHD-SET domain and associated cysteine cluster a Get druggable targets OG5_130642 All targets in OG5_130642
Echinococcus granulosus dnaJ subfamily B Get druggable targets OG5_133913 All targets in OG5_133913
Toxoplasma gondii histone lysine methyltransferase SET1 Get druggable targets OG5_130642 All targets in OG5_130642
Echinococcus multilocularis dnaJ subfamily B Get druggable targets OG5_133913 All targets in OG5_133913
Loa Loa (eye worm) transcription factor SMAD2 Get druggable targets OG5_131716 All targets in OG5_131716
Loa Loa (eye worm) MH2 domain-containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Brugia malayi MH2 domain containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Schistosoma japonicum ko:K09188 myeloid/lymphoid or mixed-lineage leukemia protein 3, putative Get druggable targets OG5_130642 All targets in OG5_130642
Schistosoma mansoni hypothetical protein Get druggable targets OG5_133913 All targets in OG5_133913
Schistosoma mansoni mixed-lineage leukemia protein mll Get druggable targets OG5_130642 All targets in OG5_130642
Schistosoma japonicum Menin, putative Get druggable targets OG5_133913 All targets in OG5_133913
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi MH2 domain containing protein SMAD family member 2 467 aa 405 aa 31.6 %
Loa Loa (eye worm) pigment dispersing factor receptor c glucagon-like peptide 1 receptor 463 aa 388 aa 25.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Leishmania major glycerol uptake protein, putative 0.0021 0.0064 0.0261
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.006 0.044 0.0436
Brugia malayi diacylglycerol acyltransferase 0.0124 0.1062 0.1062
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0019 0.0048 0.0093
Trypanosoma brucei glycerol uptake protein, putative 0.0021 0.0064 0.0261
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.008 0.0637 0.0637
Trypanosoma brucei diacylglycerol acyltransferase, putative 0.0237 0.2147 1
Echinococcus granulosus alpha 16 mannosyl glycoprotein 0.105 1 1
Schistosoma mansoni hypothetical protein 0.0031 0.0164 0.016
Schistosoma mansoni ap endonuclease 0.002 0.0059 0.0055
Trypanosoma cruzi GUP1, putative 0.0021 0.0064 0.0261
Loa Loa (eye worm) latrophilin receptor protein 2 0.0031 0.0164 0.016
Onchocerca volvulus 0.0538 0.506 1
Brugia malayi CHD4 protein 0.0015 0.0009 0.0009
Brugia malayi Bromodomain containing protein 0.0076 0.0596 0.0596
Echinococcus granulosus o acyltransferase membrane bound domain 0.0021 0.0064 0.006
Loa Loa (eye worm) hypothetical protein 0.007 0.0536 0.0532
Trichomonas vaginalis ap endonuclease, putative 0.002 0.0059 0.0118
Schistosoma mansoni hypothetical protein 0.0494 0.4631 0.4629
Entamoeba histolytica hypothetical protein, conserved 0.0021 0.0064 0.0041
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.002 0.0059 0.0237
Schistosoma mansoni hypothetical protein 0.0167 0.1477 0.1474
Entamoeba histolytica hypothetical protein 0.0021 0.0064 0.0041
Echinococcus multilocularis Membrane bound O acyl transferase, MBOAT 0.0021 0.0064 0.006
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.002 0.0059 0.0055
Schistosoma mansoni hypothetical protein 0.0052 0.0369 0.0365
Plasmodium vivax SET domain protein, putative 0.006 0.044 0.3801
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.002 0.0059 0.0237
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0019 0.0048 0.0093
Wolbachia endosymbiont of Brugia malayi leucyl-tRNA synthetase 0.0022 0.0078 0.0529
Onchocerca volvulus 0.0036 0.0212 0.0297
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0291 0.2673 0.267
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0057 0.0412 0.0408
Loa Loa (eye worm) heterochromatin protein 1 0.0069 0.0531 0.0527
Trichomonas vaginalis conserved hypothetical protein 0.0108 0.0905 0.2046
Loa Loa (eye worm) tyrosyl-tRNA synthetase 0.0036 0.0212 0.0208
Brugia malayi beta-lactamase family protein 0.008 0.0637 0.0637
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0291 0.2673 0.267
Mycobacterium tuberculosis Probable lipase LipE 0.008 0.0637 0.1217
Echinococcus granulosus sterol O acyltransferase 1 0.0021 0.0064 0.006
Brugia malayi Zinc finger, C2H2 type family protein 0.0335 0.3095 0.3095
Loa Loa (eye worm) MBOAT family protein 0.0021 0.0064 0.006
Mycobacterium tuberculosis Conserved protein 0.008 0.0637 0.1217
Schistosoma mansoni methionine-tRNA synthetase 0.0022 0.0078 0.0074
Brugia malayi wnt family protein 0.0015 0.0004 0.0004
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0019 0.0048 0.0093
Loa Loa (eye worm) diacylglycerol acyltransferase 0.0124 0.1062 0.1058
Schistosoma mansoni chromobox protein 0.0069 0.0531 0.0527
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0061 0.045 0.0446
Trichomonas vaginalis conserved hypothetical protein 0.0108 0.0905 0.2046
Loa Loa (eye worm) hypothetical protein 0.0021 0.0064 0.006
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0291 0.2673 0.267
Loa Loa (eye worm) hypothetical protein 0.0021 0.0064 0.006
Loa Loa (eye worm) hypothetical protein 0.0103 0.086 0.0856
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0291 0.2673 0.267
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0024 0.0096 0.0092
Loa Loa (eye worm) hhat protein 0.0021 0.0064 0.006
Loa Loa (eye worm) zinc finger protein 0.0335 0.3095 0.3092
Brugia malayi Pre-SET motif family protein 0.006 0.044 0.044
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0035 0.0205 0.0201
Brugia malayi methionyl-tRNA synthetase 0.0022 0.0078 0.0078
Trichomonas vaginalis D-aminoacylase, putative 0.008 0.0637 0.1436
Schistosoma mansoni hypothetical protein 0.0015 0.0008 0.0004
Echinococcus granulosus methionine tRNA synthetase 0.0059 0.0428 0.0424
Loa Loa (eye worm) CXXC zinc finger family protein 0.0035 0.0197 0.0193
Loa Loa (eye worm) hypothetical protein 0.0068 0.0515 0.0511
Loa Loa (eye worm) hypothetical protein 0.008 0.0637 0.0633
Schistosoma mansoni hypothetical protein 0.0068 0.0515 0.0511
Plasmodium vivax methionine--tRNA ligase, putative 0.0022 0.0078 0.0195
Schistosoma mansoni hypothetical protein 0.0031 0.0164 0.016
Echinococcus granulosus protein cysteine N palmitoyltransferase 0.0021 0.0064 0.006
Trichomonas vaginalis conserved hypothetical protein 0.0108 0.0905 0.2046
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0019 0.0048 0.0093
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0039 0.0237 0.0347
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0031 0.0164 0.0164
Giardia lamblia Leucyl-tRNA synthetase 0.0022 0.0078 0.0529
Loa Loa (eye worm) MH2 domain-containing protein 0.0144 0.1254 0.125
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0061 0.045 0.0446
Entamoeba histolytica methionyl-tRNA synthetase, putative 0.0022 0.0078 0.016
Echinococcus multilocularis diacylglycerol O acyltransferase 1 0.0124 0.1062 0.1058
Trichomonas vaginalis conserved hypothetical protein 0.0016 0.0012 0.0013
Brugia malayi hypothetical protein 0.0147 0.1278 0.1278
Loa Loa (eye worm) hypothetical protein 0.0022 0.0078 0.0074
Schistosoma mansoni leukocyte receptor cluster (lrc) member 4 protein 0.0021 0.0064 0.006
Trypanosoma cruzi diacylglycerol acyltransferase, putative 0.0237 0.2147 1
Echinococcus multilocularis chromobox protein 1 0.0069 0.0531 0.0527
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0021 0.0064 0.0041
Chlamydia trachomatis methionine--tRNA ligase 0.0022 0.0078 0.5
Mycobacterium ulcerans lipase LipD 0.008 0.0637 1
Loa Loa (eye worm) transcription factor SMAD2 0.0144 0.1254 0.125
Echinococcus multilocularis lysophospholipid acyltransferase 7 0.0021 0.0064 0.006
Loa Loa (eye worm) hypothetical protein 0.008 0.0637 0.0633
Trichomonas vaginalis conserved hypothetical protein 0.0066 0.0498 0.1119
Schistosoma mansoni leucyl-tRNA synthetase 0.0022 0.0078 0.0074
Toxoplasma gondii diacylglycerol acyltransferase 0.0052 0.0369 0.1483
Mycobacterium tuberculosis Probable hydrolase 0.008 0.0637 0.1217
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0147 0.1278 0.1275
Echinococcus multilocularis sterol O acyltransferase 1 0.0021 0.0064 0.006
Plasmodium vivax hypothetical protein, conserved 0.008 0.0637 0.5769
Trypanosoma brucei PAB1-binding protein , putative 0.0025 0.0106 0.0456
Trypanosoma cruzi glycerol uptake protein, putative 0.0021 0.0064 0.0261
Leishmania major glycerol uptake protein, putative 0.0021 0.0064 0.0261
Mycobacterium ulcerans esterase/lipase LipP 0.008 0.0637 1
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0021 0.0064 0.006
Schistosoma mansoni cpg binding protein 0.0039 0.0234 0.023
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0017 0.0025 0.0021
Trichomonas vaginalis D-aminoacylase, putative 0.008 0.0637 0.1436
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0099 0.0817 0.0813
Onchocerca volvulus 0.0237 0.2147 0.417
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.008 0.0637 0.0633
Schistosoma mansoni hypothetical protein 0.0031 0.0164 0.016
Leishmania major glycerol uptake protein, putative 0.0021 0.0064 0.0261
Echinococcus granulosus histone lysine methyltransferase setb 0.0077 0.0603 0.0599
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0291 0.2673 0.267
Onchocerca volvulus 0.008 0.0637 0.1148
Trichomonas vaginalis conserved hypothetical protein 0.0021 0.0064 0.013
Trichomonas vaginalis conserved hypothetical protein 0.0021 0.0064 0.013
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0077 0.0603 0.0599
Trichomonas vaginalis set domain proteins, putative 0.047 0.4396 1
Brugia malayi MH2 domain containing protein 0.0144 0.1254 0.1254
Brugia malayi exodeoxyribonuclease III family protein 0.002 0.0059 0.0059
Schistosoma mansoni diacylglycerol O-acyltransferase 1 0.0237 0.2147 0.2144
Loa Loa (eye worm) beta-lactamase 0.008 0.0637 0.0633
Loa Loa (eye worm) PHD-finger family protein 0.002 0.0059 0.0055
Loa Loa (eye worm) hypothetical protein 0.0099 0.0817 0.0813
Loa Loa (eye worm) hypothetical protein 0.008 0.0637 0.0633
Schistosoma mansoni methionine-tRNA synthetase 0.0059 0.0428 0.0424
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.002 0.0059 0.0237
Echinococcus multilocularis methionyl tRNA synthetase, cytoplasmic 0.0022 0.0078 0.0074
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0106 0.0456
Loa Loa (eye worm) hypothetical protein 0.0039 0.0237 0.0233
Trichomonas vaginalis methionine-tRNA synthetase, putative 0.0059 0.0428 0.096
Plasmodium vivax hypothetical protein, conserved 0.0022 0.0078 0.0195
Schistosoma mansoni sterol O-acyltransferase 1 0.0021 0.0064 0.006
Trichomonas vaginalis esterase, putative 0.008 0.0637 0.1436
Loa Loa (eye worm) hypothetical protein 0.0044 0.0288 0.0284
Loa Loa (eye worm) hhat protein 0.0021 0.0064 0.006
Toxoplasma gondii tRNA ligases class I (M) protein 0.0022 0.0078 0.0094
Brugia malayi beta-lactamase 0.008 0.0637 0.0637
Echinococcus multilocularis membrane bound acyltransferase:hhat 0.0021 0.0064 0.006
Loa Loa (eye worm) hypothetical protein 0.0077 0.0603 0.0599
Echinococcus multilocularis zinc finger protein 0.0021 0.0068 0.0064
Trichomonas vaginalis conserved hypothetical protein 0.0027 0.0128 0.0275
Plasmodium vivax ataxin-2 like protein, putative 0.0025 0.0106 0.0466
Brugia malayi hypothetical protein 0.0016 0.0019 0.0019
Giardia lamblia Methionyl-tRNA synthetase 0.0059 0.0428 1
Leishmania major diacylglycerol acyltransferase, putative 0.0052 0.0369 0.1685
Trypanosoma cruzi diacylglycerol acyltransferase, putative 0.0052 0.0369 0.1685
Trypanosoma cruzi glycerol uptake protein, putative 0.0021 0.0064 0.0261
Schistosoma mansoni chromobox protein 0.0069 0.0531 0.0527
Onchocerca volvulus 0.047 0.4396 0.8671
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0021 0.0064 0.0041
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0106 0.0456
Trichomonas vaginalis conserved hypothetical protein 0.0021 0.0064 0.013
Onchocerca volvulus 0.0035 0.0197 0.0267
Loa Loa (eye worm) pax transcription factor protein 2 0.0538 0.506 0.5058
Toxoplasma gondii hypothetical protein 0.0021 0.0064 0.0024
Toxoplasma gondii ABC1 family protein 0.008 0.0637 0.277
Trypanosoma cruzi diacylglycerol acyltransferase, putative 0.0052 0.0369 0.1685
Trichomonas vaginalis porcupine, putative 0.0021 0.0064 0.013
Echinococcus multilocularis leucyl tRNA synthetase 0.0022 0.0078 0.0074
Brugia malayi protein ZK524.3 0.0022 0.0078 0.0078
Trypanosoma cruzi hypothetical protein, conserved 0.008 0.0637 0.2941
Toxoplasma gondii hypothetical protein 0.0042 0.0269 0.1007
Trichomonas vaginalis conserved hypothetical protein 0.0027 0.0128 0.0275
Brugia malayi methionyl-tRNA synthetase 0.0059 0.0428 0.0428
Loa Loa (eye worm) methionyl-tRNA synthetase 0.0059 0.0428 0.0424
Schistosoma mansoni zinc finger protein 0.0015 0.0008 0.0004
Toxoplasma gondii dgat2l1-prov protein 0.0237 0.2147 1
Echinococcus granulosus methyl CpG binding domain protein 2 0.0017 0.0025 0.0021
Loa Loa (eye worm) diacylglycerol acyltransferase 0.0237 0.2147 0.2144
Leishmania major methionyl-tRNA synthetase, putative 0.0059 0.0428 0.1965
Echinococcus multilocularis methionine tRNA synthetase 0.0059 0.0428 0.0424
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.006 0.044 0.1825
Brugia malayi wnt family protein 0.0015 0.0004 0.0004
Echinococcus granulosus Membrane bound O acyl transferase MBOAT 0.0021 0.0064 0.006
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0077 0.0603 0.0599
Plasmodium falciparum methionine--tRNA ligase 0.0059 0.0428 0.3685
Loa Loa (eye worm) MBOAT family protein 0.0021 0.0064 0.006
Trichomonas vaginalis conserved hypothetical protein 0.0039 0.0237 0.0524
Mycobacterium tuberculosis Probable conserved lipoprotein 0.008 0.0637 0.1217
Trypanosoma brucei glycerol uptake protein, putative 0.0021 0.0064 0.0261
Plasmodium falciparum diacylglycerol O-acyltransferase 0.0124 0.1062 1
Echinococcus granulosus beta LACTamase domain containing family member 0.008 0.0637 0.0633
Echinococcus granulosus chromobox protein 1 0.0069 0.0531 0.0527
Toxoplasma gondii acyl-CoA:diacylglycerol acyltransferase 1-related enzyme 0.0124 0.1062 0.4801
Loa Loa (eye worm) hypothetical protein 0.0021 0.0064 0.006
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0019 0.0048 0.0093
Trypanosoma brucei methionyl-tRNA synthetase, putative 0.0059 0.0428 0.1965
Trypanosoma cruzi GUP1, putative 0.0021 0.0064 0.0261
Schistosoma mansoni cpg binding protein 0.0039 0.0234 0.023
Brugia malayi latrophilin 2 splice variant baaae 0.0068 0.0515 0.0515
Brugia malayi Wnt-2 protein precursor 0.0015 0.0004 0.0004
Toxoplasma gondii LsmAD domain-containing protein 0.0025 0.0106 0.0224
Onchocerca volvulus 0.003 0.0156 0.0185
Leishmania major leucyl-tRNA synthetase, putative 0.0022 0.0078 0.0329
Schistosoma mansoni wnt related 0.0015 0.0004 0.000000000030057
Trichomonas vaginalis chromobox protein, putative 0.0069 0.0531 0.1194
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.008 0.0637 0.1217
Plasmodium falciparum methionine--tRNA ligase, putative 0.0022 0.0078 0.0195
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0291 0.2673 0.267
Onchocerca volvulus 0.0071 0.0549 0.0972
Chlamydia trachomatis leucine--tRNA ligase 0.0022 0.0078 0.5
Echinococcus multilocularis beta LACTamase domain containing family member 0.008 0.0637 0.0633
Brugia malayi MBOAT family protein 0.0021 0.0064 0.0064
Echinococcus granulosus GPCR family 2 0.0031 0.0164 0.016
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0019 0.0048 0.0093
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0147 0.1278 0.1275
Loa Loa (eye worm) hypothetical protein 0.008 0.0637 0.0633
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0071 0.0549 0.0546
Trichomonas vaginalis chromobox protein, putative 0.0042 0.0266 0.0589
Mycobacterium ulcerans hypothetical protein 0.0052 0.0369 0.5353
Mycobacterium ulcerans beta-lactamase 0.008 0.0637 1
Schistosoma mansoni hypothetical protein 0.0147 0.1278 0.1275
Loa Loa (eye worm) hypothetical protein 0.105 1 1
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0031 0.0164 0.016
Wolbachia endosymbiont of Brugia malayi methionyl-tRNA synthetase 0.0059 0.0428 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0291 0.2673 0.2673
Echinococcus multilocularis chromobox protein 1 0.0069 0.0531 0.0527
Echinococcus granulosus o acyltransferase membrane bound domain 0.0021 0.0064 0.006
Loa Loa (eye worm) hypothetical protein 0.0021 0.0064 0.006
Echinococcus granulosus methionyl tRNA synthetase cytoplasmic 0.0022 0.0078 0.0074
Treponema pallidum methionyl-tRNA synthetase 0.0022 0.0078 1
Entamoeba histolytica hypothetical protein 0.0147 0.1278 1
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0513 0.4814 1
Mycobacterium tuberculosis Probable esterase LipL 0.008 0.0637 0.1217
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0031 0.0164 0.016
Schistosoma mansoni zinc finger protein 0.0021 0.0068 0.0064
Brugia malayi MBOAT family protein 0.0021 0.0064 0.0064
Leishmania major hypothetical protein, conserved 0.008 0.0637 0.2941
Loa Loa (eye worm) hypothetical protein 0.004 0.0251 0.0247
Treponema pallidum alginate O-acetylation protein (algI) 0.0021 0.0064 0.2562
Schistosoma mansoni hypothetical protein 0.0021 0.0064 0.006
Trichomonas vaginalis conserved hypothetical protein 0.0039 0.0237 0.0524
Brugia malayi hypothetical protein 0.0025 0.0106 0.0106
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.002 0.0059 0.0237
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0031 0.0164 0.016
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0076 0.0593 0.059
Trichomonas vaginalis conserved hypothetical protein 0.0108 0.0905 0.2046
Plasmodium vivax methionine--tRNA ligase, putative 0.0059 0.0428 0.3685
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0291 0.2673 0.267
Schistosoma mansoni methyl-cpg binding protein mbd 0.0017 0.0025 0.0021
Schistosoma mansoni cpg binding protein 0.0035 0.0197 0.0193
Loa Loa (eye worm) hypothetical protein 0.0022 0.0078 0.0074
Trypanosoma brucei diacylglycerol acyltransferase, putative 0.0052 0.0369 0.1685
Echinococcus granulosus fetal alzheimer antigen falz 0.0024 0.0096 0.0092
Loa Loa (eye worm) hypothetical protein 0.0025 0.0106 0.0102
Echinococcus granulosus membrane bound acyltransferase:hhat 0.0021 0.0064 0.006
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0035 0.0205 0.0201
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.006 0.044 0.0436
Leishmania major hypothetical protein, conserved 0.0021 0.0064 0.0261
Trichomonas vaginalis penicillin-binding protein, putative 0.008 0.0637 0.1436
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0099 0.0817 0.0817
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0024 0.0096 0.0092
Schistosoma mansoni hypothetical protein 0.0167 0.1477 0.1474
Brugia malayi Heterochromatin protein 1 0.0069 0.0531 0.0531
Trichomonas vaginalis conserved hypothetical protein 0.0108 0.0905 0.2046
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0106 0.0466
Mycobacterium ulcerans hypothetical protein 0.008 0.0637 1
Trypanosoma cruzi diacylglycerol acyltransferase, putative 0.0052 0.0369 0.1685
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0019 0.0048 0.0093
Leishmania major diacylglycerol acyltransferase, putative 0.0052 0.0369 0.1685
Mycobacterium ulcerans methionyl-tRNA synthetase 0.0059 0.0428 0.6388
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0106 0.0466
Loa Loa (eye worm) MBOAT family protein 0.0021 0.0064 0.006
Echinococcus granulosus geminin 0.0167 0.1477 0.1474
Onchocerca volvulus 0.008 0.0637 0.1148
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0291 0.2673 0.267
Echinococcus multilocularis chromodomain helicase DNA binding protein 4 0.0015 0.0009 0.0005
Schistosoma mansoni chromodomain helicase DNA binding protein 0.0015 0.0009 0.0005
Brugia malayi Wnt-4 protein precursor 0.0015 0.0004 0.0004
Trichomonas vaginalis chromobox protein, putative 0.0069 0.0531 0.1194
Leishmania major hypothetical protein, conserved 0.0025 0.0106 0.0456
Echinococcus multilocularis geminin 0.0167 0.1477 0.1474
Trypanosoma cruzi glycerol uptake protein, putative 0.0021 0.0064 0.0261
Brugia malayi CXXC zinc finger family protein 0.0035 0.0197 0.0197
Loa Loa (eye worm) membrane bound O-acyltransferase domain containing 1 0.0021 0.0064 0.006
Trypanosoma cruzi diacylglycerol acyltransferase, putative 0.0052 0.0369 0.1685
Leishmania major glycerol uptake protein, putative 0.0021 0.0064 0.0261
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.008 0.0637 1
Toxoplasma gondii mono- or diacylglycerol acyltransferase 0.0052 0.0369 0.1483
Schistosoma mansoni diacylglycerol O-acyltransferase 0.0052 0.0369 0.0365
Trypanosoma cruzi methionyl-tRNA synthetase, putative 0.0059 0.0428 0.1965
Mycobacterium tuberculosis Probable lipase LipD 0.008 0.0637 0.1217
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.008 0.0637 0.1217
Mycobacterium tuberculosis Conserved protein 0.008 0.0637 0.1217
Echinococcus multilocularis zinc finger transcription factor gli2 0.0335 0.3095 0.3092
Echinococcus multilocularis dnaJ subfamily B 0.0494 0.4631 0.4629
Trichomonas vaginalis penicillin-binding protein, putative 0.008 0.0637 0.1436
Leishmania major hypothetical protein, unknown function,protein, unknown function 0.0052 0.0369 0.1685
Echinococcus granulosus cpg binding protein 0.0039 0.0234 0.023
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0021 0.0064 0.006
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.002 0.0059 0.0055
Echinococcus multilocularis GPCR, family 2 0.0031 0.0164 0.016
Schistosoma mansoni diacylglycerol O-acyltransferase 0.0052 0.0369 0.0365
Toxoplasma gondii methionyl-tRNA synthetase 0.0059 0.0428 0.1769
Trichomonas vaginalis transmembrane protein nessy, putative 0.0021 0.0064 0.013
Brugia malayi PHD-finger family protein 0.0027 0.0119 0.0119
Brugia malayi Pre-SET motif family protein 0.0413 0.3846 0.3846
Schistosoma mansoni hypothetical protein 0.002 0.0059 0.0055
Brugia malayi Pax transcription factor protein 2 0.0538 0.506 0.506
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0021 0.0064 0.0041
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.008 0.0637 0.0633
Loa Loa (eye worm) hypothetical protein 0.003 0.0156 0.0152
Brugia malayi Calcitonin receptor-like protein seb-1 0.0099 0.0817 0.0817
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0042 0.0266 0.0404
Brugia malayi chromobox protein homolog 3 0.0039 0.0237 0.0237
Schistosoma mansoni methyl-cpg binding protein mbd 0.0017 0.0025 0.0021
Entamoeba histolytica hypothetical protein 0.0147 0.1278 1
Echinococcus multilocularis alpha 1,6 mannosyl glycoprotein 0.105 1 1
Treponema pallidum leucyl-tRNA synthetase 0.0022 0.0078 1
Leishmania major glycerol uptake protein, putative 0.0021 0.0064 0.0261
Brugia malayi MBOAT family protein 0.0021 0.0064 0.0064
Trichomonas vaginalis conserved hypothetical protein 0.0108 0.0905 0.2046
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0021 0.0064 0.006
Mycobacterium tuberculosis Methionyl-tRNA synthetase MetS (MetRS) (methionine--tRNA ligase) 0.0059 0.0428 0.0777
Schistosoma mansoni zinc finger protein 0.0021 0.0064 0.006
Plasmodium vivax diacylglycerol O-acyltransferase, putative 0.0124 0.1062 1
Trichomonas vaginalis ap endonuclease, putative 0.002 0.0059 0.0118
Loa Loa (eye worm) bromodomain containing protein 0.0017 0.0031 0.0027
Toxoplasma gondii histone lysine methyltransferase SET1 0.007 0.054 0.2304
Mycobacterium leprae conserved hypothetical protein 0.008 0.0637 1
Onchocerca volvulus 0.008 0.0637 0.1148
Brugia malayi MBOAT family protein 0.0021 0.0064 0.0064
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0413 0.3846 0.3844
Echinococcus granulosus chromobox protein 1 0.0069 0.0531 0.0527
Entamoeba histolytica hypothetical protein 0.0147 0.1278 1
Loa Loa (eye worm) hypothetical protein 0.0022 0.0078 0.0074
Trypanosoma brucei hypothetical protein, conserved 0.008 0.0637 0.2941
Trypanosoma cruzi hypothetical protein, conserved 0.008 0.0637 0.2941
Echinococcus granulosus zinc finger transcription factor gli2 0.0335 0.3095 0.3092
Mycobacterium leprae Probable lipase LipE 0.008 0.0637 1
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0016 0.0012 0.0013
Mycobacterium ulcerans leucyl-tRNA synthetase 0.0022 0.0078 0.0338
Toxoplasma gondii acyl-CoA:cholesterol acyltransferase alpha ACAT1-alpha 0.0124 0.1062 0.4801
Echinococcus granulosus diacylglycerol O acyltransferase 1 0.0124 0.1062 0.1058
Trichomonas vaginalis chromobox protein, putative 0.0042 0.0266 0.0589
Brugia malayi MBOAT family protein 0.0021 0.0064 0.0064
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0019 0.0048 0.0093
Loa Loa (eye worm) hypothetical protein 0.0038 0.0228 0.0224
Schistosoma mansoni beta-12-n-acetylglucosaminyltransferase II 0.105 1 1
Schistosoma mansoni ap endonuclease 0.002 0.0059 0.0055
Trypanosoma cruzi diacylglycerol acyltransferase, putative 0.0237 0.2147 1
Schistosoma mansoni diacylglycerol O-acyltransferase 1 0.0124 0.1062 0.1058
Brugia malayi Hhat protein 0.0021 0.0064 0.0064
Entamoeba histolytica vacuolar protein sorting 26 0.0021 0.0064 0.0041
Echinococcus granulosus chromodomain helicase DNA binding protein 4 0.0015 0.0009 0.0005
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0021 0.0064 0.006
Echinococcus granulosus lysophospholipid acyltransferase 7 0.0021 0.0064 0.006
Brugia malayi F/Y-rich N-terminus family protein 0.0015 0.0004 0.0004
Leishmania major diacylglycerol acyltransferase, putative 0.0237 0.2147 1
Schistosoma mansoni transcription factor LCR-F1 0.0147 0.1278 0.1275
Schistosoma mansoni hypothetical protein 0.0031 0.0164 0.016
Echinococcus multilocularis protein cysteine N palmitoyltransferase 0.0021 0.0064 0.006
Loa Loa (eye worm) hypothetical protein 0.0031 0.0164 0.016
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.002 0.0059 0.0055
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0021 0.0064 0.006
Echinococcus multilocularis cpg binding protein 0.0039 0.0234 0.023
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0031 0.0164 0.016
Echinococcus granulosus o acyltransferase membrane bound domain 0.0021 0.0064 0.006
Loa Loa (eye worm) hypothetical protein 0.008 0.0637 0.0633
Trichomonas vaginalis D-aminoacylase, putative 0.008 0.0637 0.1436
Trichomonas vaginalis conserved hypothetical protein 0.0108 0.0905 0.2046
Echinococcus granulosus zinc finger protein 0.0021 0.0068 0.0064
Loa Loa (eye worm) CHromoDomain protein family member 0.0015 0.0009 0.0005
Brugia malayi wnt family protein 0.0015 0.0004 0.0004
Brugia malayi wnt family protein 0.0015 0.0004 0.0004
Mycobacterium tuberculosis Conserved protein 0.008 0.0637 0.1217
Brugia malayi Bromodomain containing protein 0.0038 0.0227 0.0227
Trichomonas vaginalis conserved hypothetical protein 0.0108 0.0905 0.2046
Brugia malayi Latrophilin receptor protein 2 0.0031 0.0164 0.0164
Echinococcus granulosus dnaJ subfamily B 0.0494 0.4631 0.4629
Brugia malayi diacylglycerol acyltransferase family protein 0.0237 0.2147 0.2147
Entamoeba histolytica hypothetical protein 0.0147 0.1278 1
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0021 0.0064 0.006
Schistosoma mansoni membrane-bound acyltransferase/hhat 0.0021 0.0064 0.006
Schistosoma mansoni bromodomain containing protein 0.0064 0.0485 0.0481
Loa Loa (eye worm) hypothetical protein 0.008 0.0637 0.0633
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.008 0.0637 0.0633
Brugia malayi beta-lactamase family protein 0.008 0.0637 0.0637
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0077 0.0603 0.0599

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 2.5119 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors Targeting the Menin-MLL Interaction in MLL Related Leukemias: Competition With Texas Red Labeled MLL-derived Mutant Peptide. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 10 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588856, AID588860] ChEMBL. No reference
Potency (functional) 10.4179 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) 19.9526 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) 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

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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