Detailed information for compound 1426759

Basic information

Technical information
  • TDR Targets ID: 1426759
  • Name: 3-amino-1,4-bis(4-methylphenyl)azetidin-2-one
  • MW: 266.338 | Formula: C17H18N2O
  • H donors: 1 H acceptors: 1 LogP: 2.44 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1ccc(cc1)C1C(N)C(=O)N1c1ccc(cc1)C
  • InChi: 1S/C17H18N2O/c1-11-3-7-13(8-4-11)16-15(18)17(20)19(16)14-9-5-12(2)6-10-14/h3-10,15-16H,18H2,1-2H3
  • InChiKey: RGKWUPQSQGIZAY-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 3-amino-1,4-bis(4-methylphenyl)-2-azetidinone

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 glucosidase, beta, acid Starlite/ChEMBL No references
Homo sapiens glycoprotein hormones, alpha polypeptide 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
Toxoplasma gondii histone lysine methyltransferase SET1 Get druggable targets OG5_130642 All targets in OG5_130642
Schistosoma mansoni hypothetical protein Get druggable targets OG5_133913 All targets in OG5_133913
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Schistosoma japonicum ko:K09188 myeloid/lymphoid or mixed-lineage leukemia protein 3, putative Get druggable targets OG5_130642 All targets in OG5_130642
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Schistosoma japonicum Menin, putative Get druggable targets OG5_133913 All targets in OG5_133913
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Schistosoma mansoni mixed-lineage leukemia protein mll Get druggable targets OG5_130642 All targets in OG5_130642
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Echinococcus granulosus dnaJ subfamily B Get druggable targets OG5_133913 All targets in OG5_133913
Echinococcus multilocularis dnaJ subfamily B Get druggable targets OG5_133913 All targets in OG5_133913
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein Get druggable targets OG5_129423 All targets in OG5_129423
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
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Onchocerca volvulus Glucosylceramidase homolog Get druggable targets OG5_129423 All targets in OG5_129423
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Brugia malayi O-Glycosyl hydrolase family 30 protein Get druggable targets OG5_129423 All targets in OG5_129423
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Toxoplasma gondii intraflagellar transport protein 172, putative glycoprotein hormones, alpha polypeptide 116 aa 94 aa 26.6 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi Alpha/beta hydrolase 0.0007 0.0017 0.002
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.2266 0.2697
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0007 0.0017 0.002
Brugia malayi Lipase family protein 0.0014 0.0098 0.0117
Leishmania major hypothetical protein, unknown function 0.0014 0.0098 0.0117
Trypanosoma cruzi Lipase (class 3), putative 0.0014 0.0098 0.0117
Mycobacterium ulcerans bromoperoxidase BpoC 0.0007 0.0017 0.0017
Mycobacterium tuberculosis Possible epoxide hydrolase EphE (epoxide hydratase) (arene-oxide hydratase) 0.0007 0.0017 0.0017
Treponema pallidum carboxylesterase (est) 0.0005 0 0.5
Mycobacterium ulcerans hypothetical protein 0.0007 0.0017 0.0017
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0007 0.0017 0.002
Mycobacterium leprae POSSIBLE SECRETED PROTEASE 0.0007 0.0017 1
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0009 0.0035 0.0064
Mycobacterium ulcerans peroxidase BpoB 0.0007 0.0017 0.0017
Trypanosoma brucei hypothetical protein, conserved 0.0014 0.0098 0.0117
Entamoeba histolytica lipase, putative 0.0014 0.0098 1
Leishmania major hypothetical protein, conserved 0.0007 0.0017 0.002
Trypanosoma brucei Triglyceride lipase, putative 0.0014 0.0098 0.0117
Entamoeba histolytica hypothetical protein 0.0014 0.0098 1
Mycobacterium ulcerans lignin peroxidase LipJ 0.0007 0.0017 0.0017
Schistosoma mansoni cpg binding protein 0.0037 0.0355 0.0638
Mycobacterium ulcerans hydrolase 0.0007 0.0017 0.0017
Trichomonas vaginalis helicase, putative 0.0008 0.0027 0.0032
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0027 0.0032
Trypanosoma cruzi hypothetical protein, conserved 0.0744 0.8401 1
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.3487 0.415
Mycobacterium ulcerans hydrolase 0.0007 0.0017 0.0017
Mycobacterium ulcerans oxidoreductase 0.0007 0.0017 0.0017
Mycobacterium leprae Possible short-chain dehydrogenase EphD 0.0007 0.0017 1
Trichomonas vaginalis conserved hypothetical protein 0.0014 0.0098 0.0117
Giardia lamblia hypothetical protein 0.0014 0.0098 1
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0008 0.0027 0.0032
Leishmania major hydrolase-like protein 0.0007 0.0017 0.002
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.3487 0.415
Trichomonas vaginalis conserved hypothetical protein 0.0014 0.0098 0.0117
Trichomonas vaginalis lipase containing protein, putative 0.0744 0.8401 1
Trypanosoma cruzi hypothetical protein, conserved 0.0007 0.0017 0.002
Echinococcus multilocularis sn1 specific diacylglycerol lipase beta 0.0744 0.8401 1
Loa Loa (eye worm) lipase 0.0014 0.0098 0.0117
Plasmodium vivax hypothetical protein, conserved 0.0014 0.0098 1
Echinococcus granulosus abhydrolase domain containing protein 11 0.0007 0.0017 0.002
Onchocerca volvulus 0.0035 0.0332 0.0395
Mycobacterium ulcerans haloalkane dehalogenase 0.0007 0.0017 0.0017
Mycobacterium ulcerans proline iminopeptidase PIP 0.0007 0.0017 0.0017
Trypanosoma cruzi lipase, putative 0.0014 0.0098 0.0117
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0011 0.006 0.0071
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0007 0.0017 0.002
Mycobacterium ulcerans hypothetical protein 0.0007 0.0017 0.0017
Entamoeba histolytica hypothetical protein 0.0014 0.0098 1
Giardia lamblia Hypothetical protein 0.0014 0.0098 1
Echinococcus multilocularis lysosomal acid lipase:cholesteryl ester 0.0007 0.0017 0.002
Echinococcus multilocularis dnaJ subfamily B 0.0494 0.5559 0.6616
Trichomonas vaginalis hydrolase, putative 0.0007 0.0017 0.002
Brugia malayi hydrolase, alpha/beta fold family protein 0.0007 0.0017 0.002
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.0312 0.3487 0.415
Echinococcus granulosus sn1 specific diacylglycerol lipase beta 0.0014 0.0098 0.0117
Trichomonas vaginalis conserved hypothetical protein 0.0014 0.0098 0.0117
Leishmania major hydrolase, alpha/beta fold family-like protein 0.0007 0.0017 0.002
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0007 0.0017 0.002
Loa Loa (eye worm) lipase 0.0744 0.8401 1
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0027 0.0032
Echinococcus multilocularis abhydrolase domain containing protein 0.0007 0.0017 0.002
Trypanosoma brucei lipase domain protein, putative 0.0744 0.8401 1
Loa Loa (eye worm) CXXC zinc finger family protein 0.0035 0.0332 0.0395
Trypanosoma brucei Triglyceride lipase, putative 0.0014 0.0098 0.0117
Mycobacterium leprae Probable exported protease 0.0007 0.0017 1
Giardia lamblia Hypothetical protein 0.0014 0.0098 1
Mycobacterium ulcerans epoxide hydrolase EphB 0.0007 0.0017 0.0017
Mycobacterium ulcerans acyl-CoA synthetase 0.0007 0.0017 0.0017
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.0035 0.0042
Trichomonas vaginalis conserved hypothetical protein 0.0014 0.0098 0.0117
Leishmania major hypothetical protein, conserved 0.0014 0.0098 0.0117
Mycobacterium ulcerans epoxide hydrolase EphA 0.0007 0.0017 0.0017
Mycobacterium tuberculosis Probable epoxide hydrolase EphA (epoxide hydratase) (arene-oxide hydratase) 0.0007 0.0017 0.0017
Leishmania major hypothetical protein, conserved 0.0014 0.0098 0.0117
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0007 0.0017 0.002
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.3487 0.415
Toxoplasma gondii lipase 0.0014 0.0098 0.1435
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0027 0.0032
Mycobacterium tuberculosis Conserved protein 0.0013 0.008 0.008
Loa Loa (eye worm) abhydrolase domain-containing protein 2 0.0007 0.0017 0.002
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.2266 0.2697
Onchocerca volvulus 0.0014 0.0098 0.0117
Loa Loa (eye worm) hydrolase 0.0007 0.0017 0.002
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0027 0.0032
Brugia malayi Hypothetical 54.7 kDa protein F37A4.1 in chromosome III 0.0007 0.0017 0.002
Trypanosoma brucei lipase domain protein, putative 0.0014 0.0098 0.0117
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0027 0.0032
Brugia malayi UPF0017 protein CG3488 0.0007 0.0017 0.002
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0011 0.006 0.0071
Mycobacterium leprae Probable homoserine o-acetyltransferase MetA 0.0007 0.0017 1
Trichomonas vaginalis conserved hypothetical protein 0.0014 0.0098 0.0117
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.3487 0.415
Trypanosoma brucei lipase, putative 0.0014 0.0098 0.0117
Onchocerca volvulus Glucosylceramidase homolog 0.0205 0.2266 0.2697
Entamoeba histolytica hypothetical protein 0.0014 0.0098 1
Brugia malayi F/Y-rich N-terminus family protein 0.0011 0.0058 0.0069
Giardia lamblia hypothetical protein 0.0014 0.0098 1
Trypanosoma cruzi hydrolase-like protein 0.0007 0.0017 0.002
Brugia malayi Lipase family protein 0.0014 0.0098 0.0117
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0027 0.0032
Trypanosoma cruzi Triglyceride lipase, putative 0.0014 0.0098 0.0117
Brugia malayi Lipase family protein 0.0744 0.8401 1
Trypanosoma cruzi lipase, putative 0.0014 0.0098 0.0117
Toxoplasma gondii lipase 0.0014 0.0098 0.1435
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0027 0.0032
Brugia malayi alpha/beta hydrolase 0.0007 0.0017 0.002
Onchocerca volvulus Lipase homolog 0.0007 0.0017 0.002
Trypanosoma cruzi hypothetical protein, conserved 0.0744 0.8401 1
Trichomonas vaginalis conserved hypothetical protein 0.0014 0.0098 0.0117
Mycobacterium ulcerans non-heme haloperoxidase Hpx 0.0007 0.0017 0.0017
Entamoeba histolytica hypothetical protein 0.0014 0.0098 1
Trypanosoma cruzi lipase-like protein, putative 0.0014 0.0098 0.0117
Trypanosoma cruzi lipase, putative 0.0014 0.0098 0.0117
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.3487 0.415
Mycobacterium tuberculosis 4,9-DHSA hydrolase 0.0877 0.992 1
Leishmania major hypothetical protein, conserved 0.0014 0.0098 0.0117
Trypanosoma cruzi hypothetical protein, conserved 0.0014 0.0098 0.0117
Mycobacterium tuberculosis Probable haloalkane dehalogenase 0.0013 0.008 0.008
Echinococcus multilocularis lysosomal acid lipase:cholesteryl ester 0.0007 0.0017 0.002
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0074 0.0775 0.1393
Trypanosoma cruzi lipase domain protein, putative 0.0014 0.0098 0.0117
Echinococcus granulosus dnaJ subfamily B 0.0494 0.5559 0.6616
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0008 0.0027 0.0032
Brugia malayi hydrolase, alpha/beta fold family protein 0.0007 0.0017 0.002
Brugia malayi CXXC zinc finger family protein 0.0035 0.0332 0.0395
Trichomonas vaginalis conserved hypothetical protein 0.0014 0.0098 0.0117
Mycobacterium leprae Probable exported protease 0.0007 0.0017 1
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.3487 0.415
Loa Loa (eye worm) ab-hydrolase associated lipase region family protein 0.0007 0.0017 0.002
Mycobacterium ulcerans epoxide hydrolase EphE 0.0007 0.0017 0.0017
Mycobacterium leprae POSSIBLE EPOXIDE HYDROLASE EPHE (EPOXIDE HYDRATASE) (ARENE-OXIDE HYDRATASE) 0.0007 0.0017 1
Mycobacterium ulcerans homoserine O-acetyltransferase 0.0007 0.0017 0.0017
Toxoplasma gondii lipase 0.0014 0.0098 0.1435
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0027 0.0032
Onchocerca volvulus 0.0744 0.8401 1
Echinococcus multilocularis abhydrolase domain containing protein 3 0.0007 0.0017 0.002
Leishmania major lipase domain protein, putative 0.0014 0.0098 0.0117
Mycobacterium ulcerans short chain dehydrogenase 0.0007 0.0017 0.0017
Echinococcus granulosus mixed lineage leukemia protein mll 0.0009 0.0035 0.0042
Onchocerca volvulus Epoxide hydrolase 1 homolog 0.0007 0.0017 0.002
Trypanosoma cruzi lipase, putative 0.0014 0.0098 0.0117
Giardia lamblia ENC6 protein 0.0007 0.0017 0.175
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.0312 0.3487 0.415
Echinococcus multilocularis sn1 specific diacylglycerol lipase beta 0.0014 0.0098 0.0117
Schistosoma mansoni cpg binding protein 0.0035 0.0332 0.0597
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.0035 0.0042
Mycobacterium tuberculosis Probable exported protease 0.0007 0.0017 0.0017
Trypanosoma cruzi hydrolase-like protein, putative 0.0007 0.0017 0.002
Trichomonas vaginalis conserved hypothetical protein 0.0014 0.0098 0.0117
Trichomonas vaginalis conserved hypothetical protein 0.0014 0.0098 0.0117
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.2266 0.2697
Echinococcus multilocularis abhydrolase domain containing protein 16A 0.0007 0.0017 0.002
Entamoeba histolytica hypothetical protein 0.0014 0.0098 1
Trypanosoma cruzi lipase, putative 0.0014 0.0098 0.0117
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0027 0.0032
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0027 0.0032
Entamoeba histolytica lipase, putative 0.0014 0.0098 1
Loa Loa (eye worm) hypothetical protein 0.0007 0.0017 0.002
Trypanosoma cruzi hydrolase, alpha/beta fold family, putative 0.0007 0.0017 0.002
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.2266 0.2697
Mycobacterium tuberculosis Possible haloalkane dehalogenase DhaA (1-chlorohexane halidohydrolase) 0.0007 0.0017 0.0017
Mycobacterium ulcerans hypothetical protein 0.0007 0.0017 0.0017
Giardia lamblia Hypothetical protein 0.0014 0.0098 1
Trichomonas vaginalis conserved hypothetical protein 0.0014 0.0098 0.0117
Trypanosoma brucei triacylglycerol lipase, putative 0.0014 0.0098 0.0117
Mycobacterium tuberculosis Possible haloalkane dehalogenase 0.0013 0.008 0.008
Mycobacterium ulcerans epoxide hydrolase EphF 0.0007 0.0017 0.0017
Trypanosoma cruzi lipase domain protein, putative 0.0014 0.0098 0.0117
Trypanosoma brucei Lipase (class 3), putative 0.0014 0.0098 0.0117
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0027 0.0032
Schistosoma mansoni lipase 0.0014 0.0098 0.0177
Toxoplasma gondii homoserine O-acetyltransferase, putative 0.0007 0.0017 0.0251
Leishmania major hypothetical protein, conserved 0.0744 0.8401 1
Echinococcus granulosus cpg binding protein 0.0037 0.0355 0.0422
Mycobacterium ulcerans hypothetical protein 0.0007 0.0017 0.0017
Trypanosoma brucei lipase-like protein, putative 0.0014 0.0098 0.0117
Trichomonas vaginalis glucosylceramidase, putative 0.0216 0.2392 0.2847
Leishmania major hydrolase-like protein,esterase-like protein 0.0007 0.0017 0.002
Trypanosoma brucei hydrolase, alpha/beta fold family, putative 0.0007 0.0017 0.002
Echinococcus multilocularis cpg binding protein 0.0037 0.0355 0.0422
Brugia malayi Lipase family protein 0.0014 0.0098 0.0117
Leishmania major lipase, putative;with=GeneDB:LinJ31_V3.0860 0.0014 0.0098 0.0117
Entamoeba histolytica lipase, putative 0.0014 0.0098 1
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.2266 0.2697
Onchocerca volvulus 0.0014 0.0098 0.0117
Entamoeba histolytica lipase, putative 0.0014 0.0098 1
Loa Loa (eye worm) lipase 0.0014 0.0098 0.0117
Entamoeba histolytica hypothetical protein 0.0014 0.0098 1
Trichomonas vaginalis valacyclovir hydrolase, putative 0.0007 0.0017 0.002
Plasmodium falciparum lipase, putative 0.0014 0.0098 1
Brugia malayi Lipase family protein 0.0014 0.0098 0.0117
Echinococcus multilocularis abhydrolase domain containing protein 11 0.0007 0.0017 0.002
Echinococcus granulosus abhydrolase domain containing protein 3 0.0007 0.0017 0.002
Onchocerca volvulus 0.0014 0.0098 0.0117
Mycobacterium ulcerans lipase/esterase 0.0007 0.0017 0.0017
Toxoplasma gondii alpha/beta hydrolase, putative 0.0007 0.0017 0.0251
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0009 0.0035 0.0042
Trypanosoma brucei lipase domain protein, putative 0.0744 0.8401 1
Mycobacterium tuberculosis Probable oxidoreductase 0.0013 0.008 0.008
Schistosoma mansoni family S33 non-peptidase homologue (S33 family) 0.0007 0.0017 0.0031
Onchocerca volvulus Lipase homolog 0.0007 0.0017 0.002
Trichomonas vaginalis lipase containing protein, putative 0.0744 0.8401 1
Mycobacterium ulcerans lipase/esterase 0.0007 0.0017 0.0017
Echinococcus granulosus abhydrolase domain containing protein 0.0007 0.0017 0.002
Mycobacterium ulcerans exported protease 0.0007 0.0017 0.0017
Leishmania major hydrolase-like protein,esterase-like protein 0.0007 0.0017 0.002
Trichomonas vaginalis conserved hypothetical protein 0.0014 0.0098 0.0117
Loa Loa (eye worm) hypothetical protein 0.0007 0.0017 0.002
Trichomonas vaginalis conserved hypothetical protein 0.0014 0.0098 0.0117
Trypanosoma cruzi lipase, putative 0.0014 0.0098 0.0117
Trichomonas vaginalis conserved hypothetical protein 0.0014 0.0098 0.0117
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0007 0.0017 0.002
Schistosoma mansoni hydrolase 0.0007 0.0017 0.0031
Trypanosoma cruzi hypothetical protein, conserved 0.0007 0.0017 0.002
Trypanosoma cruzi hydrolase-like protein, putative 0.0007 0.0017 0.002
Mycobacterium tuberculosis Possible epoxide hydrolase EphF (epoxide hydratase) (arene-oxide hydratase) 0.0007 0.0017 0.0017
Leishmania major hypothetical protein, conserved 0.0007 0.0017 0.002
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0027 0.0032
Loa Loa (eye worm) histone methyltransferase 0.0011 0.006 0.0071
Entamoeba histolytica hypothetical protein 0.0014 0.0098 1
Leishmania major serine peptidase, putative,serine peptidase, Clan SC, Family S9D 0.0007 0.0017 0.002
Leishmania major hypothetical protein, unknown function 0.0014 0.0098 0.0117
Trichomonas vaginalis lipase containing protein, putative 0.0014 0.0098 0.0117
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.2266 0.2697
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0027 0.0032
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0027 0.0032
Schistosoma mansoni cpg binding protein 0.0037 0.0355 0.0638
Trypanosoma cruzi lipase, putative 0.0014 0.0098 0.0117
Entamoeba histolytica hypothetical protein 0.0014 0.0098 1
Trypanosoma brucei hydrolase, alpha/beta fold family, putative 0.0007 0.0017 0.002
Toxoplasma gondii lipase 0.0014 0.0098 0.1435
Leishmania major hydrolase, alpha/beta fold family, putative 0.0007 0.0017 0.002
Leishmania major lipase, putative 0.0014 0.0098 0.0117
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0027 0.0032
Mycobacterium tuberculosis Possible peroxidase BpoB (non-haem peroxidase) 0.0007 0.0017 0.0017
Trichomonas vaginalis conserved hypothetical protein 0.0014 0.0098 0.0117
Leishmania major class 3 lipase, putative 0.0014 0.0098 0.0117
Mycobacterium tuberculosis Probable homoserine O-acetyltransferase MetA (homoserine O-trans-acetylase) (homoserine transacetylase) (HTA) 0.0007 0.0017 0.0017
Mycobacterium tuberculosis Probable carboxylesterase CaeA 0.0007 0.0017 0.0017
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.2266 0.2697
Leishmania major lipase precursor-like protein 0.0014 0.0098 0.0117
Echinococcus multilocularis abhydrolase domain containing 3 0.0007 0.0017 0.002
Toxoplasma gondii histone lysine methyltransferase SET1 0.0066 0.0685 1
Mycobacterium ulcerans haloalkane dehalogenase 0.0007 0.0017 0.0017
Trypanosoma cruzi hypothetical protein, conserved 0.0007 0.0017 0.002
Trypanosoma cruzi hypothetical protein, conserved 0.0014 0.0098 0.0117
Schistosoma mansoni hypothetical protein 0.0494 0.5559 1
Echinococcus granulosus sn1 specific diacylglycerol lipase beta 0.0744 0.8401 1
Mycobacterium tuberculosis Possible short-chain dehydrogenase EphD 0.0007 0.0017 0.0017
Trypanosoma cruzi lipase, putative 0.0014 0.0098 0.0117
Mycobacterium ulcerans exported protease 0.0007 0.0017 0.0017
Echinococcus granulosus lysosomal acid lipase:cholesteryl ester 0.0007 0.0017 0.002
Trypanosoma cruzi hypothetical protein, conserved 0.0014 0.0098 0.0117
Trichomonas vaginalis glucosylceramidase, putative 0.0216 0.2392 0.2847

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 3.1623 uM PubChem BioAssay. qHTS for Activators of Integrin-Mediated Alleviation for Muscular Dystrophy. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 10.4179 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 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) 15.8489 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors and Activators of N370S glucocerebrosidase as a Potential Chaperone Treatment of Gaucher Disease. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID1473, AID2293, AID2577, AID2578, AID2587, AID2588, AID2589, AID2590, AID2592, AID2593, AID2595, AID2596, AID2597, AID2613, AID2671, AID488845] ChEMBL. No reference
Potency (functional) 31.6228 uM PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (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.
 
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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