Detailed information for compound 1429876

Basic information

Technical information
  • TDR Targets ID: 1429876
  • Name: ethyl 2,5-dimethyl-4-(2-pyridin-2-ylethylamin o)thieno[5,4-d]pyrimidine-6-carboxylate
  • MW: 356.442 | Formula: C18H20N4O2S
  • H donors: 1 H acceptors: 4 LogP: 4.11 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOC(=O)c1sc2c(c1C)c(NCCc1ccccn1)nc(n2)C
  • InChi: 1S/C18H20N4O2S/c1-4-24-18(23)15-11(2)14-16(21-12(3)22-17(14)25-15)20-10-8-13-7-5-6-9-19-13/h5-7,9H,4,8,10H2,1-3H3,(H,20,21,22)
  • InChiKey: NXAVVJUNYNELPG-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • ethyl 2,5-dimethyl-4-[2-(2-pyridyl)ethylamino]thieno[5,4-d]pyrimidine-6-carboxylate
  • 2,5-dimethyl-4-[2-(2-pyridyl)ethylamino]-6-thieno[5,4-d]pyrimidinecarboxylic acid ethyl ester
  • 2,5-dimethyl-4-[2-(2-pyridyl)ethylamino]thieno[5,4-d]pyrimidine-6-carboxylic acid ethyl ester
  • MLS001007634
  • SMR000384776
  • T0517-5356

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens GNAS complex locus Starlite/ChEMBL No references
Homo sapiens nuclear factor, erythroid 2-like 2 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain Get druggable targets OG5_131088 All targets in OG5_131088
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Schistosoma mansoni GTP-binding protein alpha subunit gna GNAS complex locus 394 aa 450 aa 28.7 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Plasmodium vivax PST-A protein 0.0026 0.0073 0.009
Toxoplasma gondii phospholipase 0.0026 0.0073 0.1978
Plasmodium vivax unspecified product 0.0026 0.0073 0.009
Schistosoma mansoni fatty-acid amide hydrolase 0.0064 0.0828 0.0828
Echinococcus multilocularis monoacylglycerol lipase abhd12 0.0026 0.0073 0.0073
Loa Loa (eye worm) hypothetical protein 0.0041 0.0368 0.0368
Leishmania major hypothetical protein, conserved 0.0029 0.0128 0.0158
Schistosoma mansoni peptidase 0.0026 0.0073 0.0073
Entamoeba histolytica hydrolase, alpha/beta fold family domain containing protein 0.0026 0.0073 0.009
Echinococcus granulosus abhydrolase domain containing 3 0.0026 0.0073 0.0073
Entamoeba histolytica hypothetical protein 0.0043 0.0421 0.0519
Entamoeba histolytica hydrolase, alpha/beta fold family domain containing protein 0.0436 0.8104 1
Leishmania major hypothetical protein, conserved 0.0064 0.0828 0.1021
Toxoplasma gondii peptidase S15, putative 0.0026 0.0073 0.1978
Plasmodium vivax hypothetical protein, conserved 0.0026 0.0073 0.009
Leishmania major hypothetical protein, conserved 0.0041 0.0368 0.0453
Plasmodium vivax hypothetical protein, conserved 0.0026 0.0073 0.009
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0652 0.0652
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0026 0.0073 0.009
Mycobacterium tuberculosis Probable amidase AmiD (acylamidase) (acylase) 0.0064 0.0828 0.1021
Trypanosoma cruzi serine peptidase, putative 0.0026 0.0073 0.009
Mycobacterium tuberculosis Conserved hypothetical protein 0.0026 0.0073 0.009
Mycobacterium tuberculosis Probable amidase AmiA2 (aminohydrolase) 0.0064 0.0828 0.1021
Toxoplasma gondii phospholipase/carboxylesterase 0.0026 0.0073 0.1978
Plasmodium falciparum epoxide hydrolase 2 0.0026 0.0073 0.009
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0026 0.0073 0.009
Plasmodium falciparum lysophospholipase, putative 0.0436 0.8104 1
Mycobacterium tuberculosis Possible amidase (aminohydrolase) 0.0064 0.0828 0.1021
Plasmodium vivax PST-A protein 0.0026 0.0073 0.009
Loa Loa (eye worm) hypothetical protein 0.0041 0.0368 0.0368
Trypanosoma brucei monoglyceride lipase, putative 0.0436 0.8104 1
Loa Loa (eye worm) hypothetical protein 0.0041 0.0368 0.0368
Mycobacterium ulcerans peptide amidase, GatA 0.0064 0.0828 0.1021
Plasmodium falciparum alpha/beta hydrolase, putative 0.0026 0.0073 0.009
Brugia malayi hypothetical protein 0.0029 0.0128 0.0128
Trichomonas vaginalis conserved hypothetical protein 0.0026 0.0073 0.009
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0532 1 1
Mycobacterium ulcerans hypothetical protein 0.0026 0.0073 0.009
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0064 0.0828 0.0828
Leishmania major monoglyceride lipase, putative 0.0436 0.8104 1
Trichomonas vaginalis conserved hypothetical protein 0.0026 0.0073 0.009
Plasmodium falciparum alpha/beta hydrolase, putative 0.0026 0.0073 0.009
Mycobacterium tuberculosis Probable lipase LipE 0.0041 0.0368 0.0453
Plasmodium falciparum ataxin-2 like protein, putative 0.0029 0.0128 0.0158
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0652 0.0652
Trichomonas vaginalis conserved hypothetical protein 0.0436 0.8104 1
Plasmodium falciparum prodrug activation and resistance esterase 0.0026 0.0073 0.009
Trichomonas vaginalis D-aminoacylase, putative 0.0041 0.0368 0.0453
Schistosoma mansoni family S9 unassigned peptidase (S09 family) 0.0026 0.0073 0.0073
Trichomonas vaginalis valacyclovir hydrolase, putative 0.0436 0.8104 1
Plasmodium falciparum exported lipase 2 0.0026 0.0073 0.009
Schistosoma mansoni family S9 unassigned peptidase (S09 family) 0.0026 0.0073 0.0073
Mycobacterium leprae PROBABLE GLUTAMYL-TRNA(GLN) AMIDOTRANSFERASE (SUBUNIT A) GATA (Glu-ADT SUBUNIT A) 0.0064 0.0828 0.0595
Toxoplasma gondii hypothetical protein 0.0026 0.0073 0.1978
Loa Loa (eye worm) hypothetical protein 0.0041 0.0368 0.0368
Entamoeba histolytica hypothetical protein 0.0043 0.0421 0.0519
Brugia malayi putative amidase 0.0064 0.0828 0.0828
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0652 0.0652
Toxoplasma gondii hydrolase, alpha/beta fold family protein 0.0026 0.0073 0.1978
Onchocerca volvulus 0.0041 0.0368 0.5
Echinococcus multilocularis Phospholipase carboxylesterase 0.0026 0.0073 0.0073
Mycobacterium ulcerans beta-lactamase 0.0041 0.0368 0.0453
Loa Loa (eye worm) amidase 0.0064 0.0828 0.0828
Plasmodium falciparum alpha/beta hydrolase fold domain containing protein, putative 0.0026 0.0073 0.009
Mycobacterium tuberculosis Probable hydrolase 0.0041 0.0368 0.0453
Trypanosoma cruzi PAB1-binding protein , putative 0.0029 0.0128 0.0158
Trypanosoma brucei Alpha/beta hydrolase family, putative 0.0026 0.0073 0.009
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0041 0.0368 0.0368
Plasmodium vivax PST-A protein 0.0026 0.0073 0.009
Trypanosoma cruzi hypothetical protein, conserved 0.0041 0.0368 0.0453
Echinococcus multilocularis beta LACTamase domain containing family member 0.0041 0.0368 0.0368
Trichomonas vaginalis conserved hypothetical protein 0.0026 0.0073 0.009
Brugia malayi Amidase family protein 0.0064 0.0828 0.0828
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0041 0.0368 0.0453
Plasmodium falciparum glutamyl-tRNA(Gln) amidotransferase subunit A 0.0064 0.0828 0.1021
Plasmodium falciparum lysophospholipase, putative 0.0026 0.0073 0.009
Plasmodium falciparum alpha/beta hydrolase, putative 0.0026 0.0073 0.009
Plasmodium vivax alpha/beta hydrolase, putative 0.0026 0.0073 0.009
Trypanosoma cruzi monoglyceride lipase, putative 0.0436 0.8104 1
Brugia malayi beta-lactamase family protein 0.0041 0.0368 0.0368
Onchocerca volvulus 0.0041 0.0368 0.5
Toxoplasma gondii hypothetical protein 0.0026 0.0073 0.1978
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0026 0.0073 0.009
Loa Loa (eye worm) hypothetical protein 0.0026 0.0073 0.0073
Brugia malayi MGC83647 protein 0.0026 0.0073 0.0073
Plasmodium falciparum exported lipase 1 0.0026 0.0073 0.009
Plasmodium vivax ataxin-2 like protein, putative 0.0029 0.0128 0.0158
Mycobacterium tuberculosis Conserved protein 0.0041 0.0368 0.0453
Trichomonas vaginalis Clan SC, family S9, unassigned serine peptidase 0.0026 0.0073 0.009
Toxoplasma gondii ABC1 family protein 0.0041 0.0368 1
Trypanosoma cruzi hypothetical protein, conserved 0.0041 0.0368 0.0453
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0041 0.0368 0.0453
Entamoeba histolytica hypothetical protein 0.0043 0.0421 0.0519
Mycobacterium ulcerans lipase LipD 0.0041 0.0368 0.0453
Leishmania major hypothetical protein, conserved 0.0026 0.0073 0.009
Entamoeba histolytica ;Alias 0.0026 0.0073 0.009
Mycobacterium ulcerans hypothetical protein 0.0436 0.8104 1
Entamoeba histolytica hypothetical protein 0.0026 0.0073 0.009
Toxoplasma gondii esterase/lipase/thioesterase domain-containing protein 0.0026 0.0073 0.1978
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0041 0.0368 0.0453
Mycobacterium tuberculosis Conserved protein 0.0041 0.0368 0.0453
Mycobacterium tuberculosis Probable lipase LipD 0.0041 0.0368 0.0453
Mycobacterium ulcerans lysophospholipase 0.0436 0.8104 1
Trichomonas vaginalis Clan SC, family S9, unassigned serine peptidase 0.0026 0.0073 0.009
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0652 0.0652
Loa Loa (eye worm) hypothetical protein 0.0041 0.0368 0.0368
Onchocerca volvulus 0.0041 0.0368 0.5
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0436 0.8104 1
Plasmodium falciparum BEM46-like protein, putative 0.0026 0.0073 0.009
Loa Loa (eye worm) hypothetical protein 0.0026 0.0073 0.0073
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0026 0.0073 0.009
Trypanosoma cruzi PAB1-binding protein , putative 0.0029 0.0128 0.0158
Loa Loa (eye worm) amidase 0.0064 0.0828 0.0828
Echinococcus multilocularis glutamyl tRNA(Gln) amidotransferase subunit A 0.0064 0.0828 0.0828
Trypanosoma brucei PAB1-binding protein , putative 0.0029 0.0128 0.0158
Mycobacterium leprae POSSIBLE LYSOPHOSPHOLIPASE 0.0436 0.8104 1
Mycobacterium ulcerans amidase 0.0064 0.0828 0.1021
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0043 0.0421 0.0421
Giardia lamblia Cgi67 serine protease precursor-like protein 0.0026 0.0073 1
Plasmodium vivax alpha/beta hydrolase, putative 0.0026 0.0073 0.009
Plasmodium vivax unspecified product 0.0026 0.0073 0.009
Mycobacterium ulcerans amidase 0.0064 0.0828 0.1021
Mycobacterium leprae PROBABLE AMIDASE AMIC (AMINOHYDROLASE) 0.0064 0.0828 0.0595
Trypanosoma brucei monoglyceride lipase, putative 0.0436 0.8104 1
Plasmodium falciparum alpha/beta-hydrolase, putative 0.0026 0.0073 0.009
Mycobacterium ulcerans hypothetical protein 0.0041 0.0368 0.0453
Plasmodium vivax PST-A protein 0.0436 0.8104 1
Mycobacterium ulcerans esterase/lipase LipP 0.0041 0.0368 0.0453
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0041 0.0368 0.0453
Trichomonas vaginalis conserved hypothetical protein 0.0026 0.0073 0.009
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0652 0.0652
Plasmodium vivax lysophospholipase, putative 0.0026 0.0073 0.009
Trypanosoma cruzi hydrolase, alpha/beta fold family, putative 0.0026 0.0073 0.009
Trichomonas vaginalis penicillin-binding protein, putative 0.0041 0.0368 0.0453
Schistosoma mansoni fatty-acid amide hydrolase 0.0532 1 1
Mycobacterium tuberculosis Probable amidase AmiB2 (aminohydrolase) 0.0064 0.0828 0.1021
Plasmodium falciparum esterase, putative 0.0436 0.8104 1
Loa Loa (eye worm) hypothetical protein 0.0041 0.0368 0.0368
Plasmodium vivax hypothetical protein, conserved 0.0026 0.0073 0.009
Loa Loa (eye worm) hypothetical protein 0.0026 0.0073 0.0073
Treponema pallidum aspartyl/glutamyl-tRNA amidotransferase subunit A 0.0064 0.0828 1
Trypanosoma cruzi Alpha/beta hydrolase family, putative 0.0026 0.0073 0.009
Schistosoma mansoni amidase 0.0532 1 1
Trichomonas vaginalis D-aminoacylase, putative 0.0041 0.0368 0.0453
Loa Loa (eye worm) beta-lactamase 0.0041 0.0368 0.0368
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0652 0.0652
Toxoplasma gondii hydrolase, alpha/beta fold family protein 0.0026 0.0073 0.1978
Loa Loa (eye worm) hypothetical protein 0.0532 1 1
Echinococcus granulosus glutamyl tRNAGln amidotransferase subunit A 0.0064 0.0828 0.0828
Mycobacterium ulcerans amidase 0.0064 0.0828 0.1021
Toxoplasma gondii LsmAD domain-containing protein 0.0029 0.0128 0.3489
Trypanosoma cruzi Alpha/beta hydrolase family, putative 0.0026 0.0073 0.009
Schistosoma mansoni transcription factor LCR-F1 0.0043 0.0421 0.0421
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.0652 0.0652
Plasmodium falciparum esterase, putative 0.0026 0.0073 0.009
Trypanosoma cruzi serine peptidase, putative 0.0026 0.0073 0.009
Echinococcus multilocularis abhydrolase domain containing 3 0.0026 0.0073 0.0073
Loa Loa (eye worm) hypothetical protein 0.0026 0.0073 0.0073
Trypanosoma cruzi Alpha/beta hydrolase family, putative 0.0026 0.0073 0.009
Mycobacterium tuberculosis Probable esterase LipL 0.0041 0.0368 0.0453
Toxoplasma gondii protein c14orf29, putative 0.0026 0.0073 0.1978
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0041 0.0368 0.0368
Trichomonas vaginalis conserved hypothetical protein 0.0026 0.0073 0.009
Trichomonas vaginalis Clan SC, family S9, unassigned serine peptidase 0.0026 0.0073 0.009
Entamoeba histolytica hypothetical protein 0.0026 0.0073 0.009
Brugia malayi Amidase family protein 0.0064 0.0828 0.0828
Brugia malayi Protein C20orf22 0.0026 0.0073 0.0073
Loa Loa (eye worm) hypothetical protein 0.0026 0.0073 0.0073
Echinococcus granulosus fatty acid amide hydrolase 1 0.0532 1 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0041 0.0368 0.0453
Toxoplasma gondii hypothetical protein 0.0026 0.0073 0.1978
Trichomonas vaginalis Clan SC, family S9, unassigned serine peptidase 0.0026 0.0073 0.009
Plasmodium falciparum alpha/beta hydrolase, putative 0.0026 0.0073 0.009
Plasmodium vivax PST-A protein 0.0026 0.0073 0.009
Entamoeba histolytica hydrolase, alpha/beta fold family domain containing protein 0.0436 0.8104 1
Mycobacterium tuberculosis Possible penicillin-binding protein 0.026 0.4667 0.5759
Trypanosoma brucei Alpha/beta hydrolase family, putative 0.0026 0.0073 0.009
Schistosoma mansoni hypothetical protein 0.0043 0.0421 0.0421
Mycobacterium tuberculosis Probable amidase AmiC (aminohydrolase) 0.0064 0.0828 0.1021
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0436 0.8104 1
Trypanosoma cruzi Serine peptidase, Clan SC, Family S09X, putative 0.0026 0.0073 0.009
Mycobacterium tuberculosis Conserved protein 0.0041 0.0368 0.0453
Chlamydia trachomatis glutamyl-tRNA(Gln) amidotransferase subunit A 0.0064 0.0828 1
Trypanosoma cruzi amidase, putative 0.0064 0.0828 0.1021
Mycobacterium ulcerans amidase 0.0064 0.0828 0.1021
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0436 0.8104 1
Plasmodium falciparum lysophospholipase, putative 0.0436 0.8104 1
Plasmodium vivax lysophospholipase, putative 0.0026 0.0073 0.009
Trichomonas vaginalis Clan SC, family S9, unassigned serine peptidase 0.0026 0.0073 0.009
Echinococcus granulosus Phospholipase carboxylesterase 0.0026 0.0073 0.0073
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0436 0.8104 1
Brugia malayi MGC79044 protein 0.0026 0.0073 0.0073
Trichomonas vaginalis esterase, putative 0.0041 0.0368 0.0453
Echinococcus granulosus abhydrolase domain containing protein 13 0.0026 0.0073 0.0073
Plasmodium falciparum alpha/beta hydrolase, putative 0.0026 0.0073 0.009
Mycobacterium ulcerans aspartyl/glutamyl-tRNA amidotransferase subunit A 0.0064 0.0828 0.1021
Trypanosoma brucei fatty-acid amide hydrolase, putative 0.0064 0.0828 0.1021
Brugia malayi beta-lactamase 0.0041 0.0368 0.0368
Mycobacterium tuberculosis Possible lysophospholipase 0.0436 0.8104 1
Trypanosoma brucei hypothetical protein, conserved 0.0041 0.0368 0.0453
Plasmodium vivax PST-A protein 0.0026 0.0073 0.009
Leishmania major hypothetical protein, conserved 0.0026 0.0073 0.009
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0043 0.0421 0.0421
Trichomonas vaginalis conserved hypothetical protein 0.0026 0.0073 0.009
Mycobacterium ulcerans hypothetical protein 0.0026 0.0073 0.009
Plasmodium vivax hypothetical protein, conserved 0.0041 0.0368 0.0453
Trichomonas vaginalis conserved hypothetical protein 0.0026 0.0073 0.009
Plasmodium falciparum ataxin-2 like protein, putative 0.0029 0.0128 0.0158
Plasmodium falciparum lysophospholipase, putative 0.0436 0.8104 1
Trichomonas vaginalis D-aminoacylase, putative 0.0041 0.0368 0.0453
Plasmodium falciparum lysophospholipase, putative 0.0026 0.0073 0.009
Brugia malayi hypothetical protein 0.0043 0.0421 0.0421
Echinococcus granulosus fatty acid amide hydrolase 1 0.0064 0.0828 0.0828
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0436 0.8104 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0041 0.0368 0.0368
Trichomonas vaginalis conserved hypothetical protein 0.0436 0.8104 1
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0041 0.0368 0.0368
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.0652 0.0652
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0652 0.0652
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0532 1 1
Entamoeba histolytica hypothetical protein 0.0043 0.0421 0.0519
Trypanosoma brucei Serine peptidase, Clan SC, Family S09X 0.0026 0.0073 0.009
Mycobacterium ulcerans amidase 0.0064 0.0828 0.1021
Brugia malayi beta-lactamase family protein 0.0041 0.0368 0.0368
Mycobacterium ulcerans hydrolase 0.0026 0.0073 0.009
Schistosoma mansoni glutamyl-tRNA(Gln) amidotransferase subunit A 0.0064 0.0828 0.0828
Echinococcus granulosus monoacylglycerol lipase abhd12 0.0026 0.0073 0.0073
Leishmania major Bem46-like serine peptidase,Serine peptidase, Clan SC, Family S09X 0.0026 0.0073 0.009
Trypanosoma cruzi amidase, putative 0.0064 0.0828 0.1021
Wolbachia endosymbiont of Brugia malayi aspartyl/glutamyl-tRNA amidotransferase subunit A 0.0064 0.0828 1
Trichomonas vaginalis conserved hypothetical protein 0.0026 0.0073 0.009
Echinococcus granulosus fatty acid amide hydrolase 1 0.0532 1 1
Plasmodium vivax glutamyl-tRNA(Gln) amidotransferase subunit A, putative 0.0064 0.0828 0.1021
Plasmodium falciparum esterase, putative 0.0026 0.0073 0.009
Echinococcus granulosus beta LACTamase domain containing family member 0.0041 0.0368 0.0368
Loa Loa (eye worm) hypothetical protein 0.0029 0.0128 0.0128
Trichomonas vaginalis conserved hypothetical protein 0.0026 0.0073 0.009
Toxoplasma gondii hypothetical protein 0.0026 0.0073 0.1978
Plasmodium vivax lysophospholipase, putative 0.0026 0.0073 0.009

Activities

Activity type Activity value Assay description Source 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) 11.6891 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 12.5893 uM PubChem BioAssay. qHTS for Antagonists of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 14.581 uM PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] ChEMBL. No reference
Potency (functional) 20.5878 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125] ChEMBL. No reference
Potency (functional) = 28.1838 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))] ChEMBL. No reference
Potency (functional) = 31.6228 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human Jumonji Domain Containing 2E (JMJD2E). (Class of assay: confirmatory) ChEMBL. No reference
Potency (binding) = 31.6228 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Thioflavin T Binding. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) 79.4328 uM PUBCHEM_BIOASSAY: qHTS Assay for Substrates of Mammalian Selenoprotein Thioredoxin Reductase 1 (TrxR1): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488771] ChEMBL. No reference
Potency (functional) 79.4328 uM PubChem BioAssay. qHTS of PTHR Inhibitors: Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 79.4328 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
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

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

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

No literature references available for this target.

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