Detailed information for compound 1297829

Basic information

Technical information
  • TDR Targets ID: 1297829
  • Name: (E)-3-(2,4-dichlorophenyl)prop-2-enehydrazide
  • MW: 231.079 | Formula: C9H8Cl2N2O
  • H donors: 2 H acceptors: 1 LogP: 2.13 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: NNC(=O)/C=C/c1ccc(cc1Cl)Cl
  • InChi: 1S/C9H8Cl2N2O/c10-7-3-1-6(8(11)5-7)2-4-9(14)13-12/h1-5H,12H2,(H,13,14)/b4-2+
  • InChiKey: WWOAAMJEUHUILM-DUXPYHPUSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 3-(2,4-dichlorophenyl)prop-2-enehydrazide
  • (E)-3-(2,4-dichlorophenyl)acrylohydrazide
  • 3-(2,4-dichlorophenyl)acrylohydrazide
  • (E)-3-(2,4-dichlorophenyl)-2-propenohydrazide
  • MLS000721495
  • SMR000337135
  • 3R-1072

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens glucosidase, alpha Starlite/ChEMBL No references
Homo sapiens aldehyde dehydrogenase 1 family, member A1 Starlite/ChEMBL No references
Homo sapiens l(3)mbt-like 1 (Drosophila) Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus multilocularis lysosomal alpha glucosidase Get druggable targets OG5_127055 All targets in OG5_127055
Schistosoma japonicum Retinal dehydrogenase 1, putative Get druggable targets OG5_126638 All targets in OG5_126638
Neospora caninum hypothetical protein Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans closely related to C. albicans GCA1 cell wall mannoprotein glycosyl hydrolase Get druggable targets OG5_127055 All targets in OG5_127055
Echinococcus granulosus aldehyde dehydrogenase mitochondrial Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus granulosus endonuclease exonuclease phosphatase Get druggable targets OG5_130415 All targets in OG5_130415
Candida albicans hypothetical protein Get druggable targets OG5_127055 All targets in OG5_127055
Schistosoma japonicum ko:K00128 aldehyde dehydrogenase (NAD+) [EC1.2.1.3], putative Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans hypothetical protein Get druggable targets OG5_127055 All targets in OG5_127055
Candida albicans Mitochondrial aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Toxoplasma gondii aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma mansoni aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Loa Loa (eye worm) glycosyl hydrolase family 31 protein Get druggable targets OG5_127055 All targets in OG5_127055
Leishmania major aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma mansoni alpha-glucosidase Get druggable targets OG5_127055 All targets in OG5_127055
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans hypothetical protein Get druggable targets OG5_127055 All targets in OG5_127055
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania donovani aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum Aldehyde dehydrogenase, mitochondrial precursor, putative Get druggable targets OG5_126638 All targets in OG5_126638
Brugia malayi Glycosyl hydrolases family 31 protein Get druggable targets OG5_127055 All targets in OG5_127055
Schistosoma japonicum ko:K01187 alpha-glucosidase [EC3.2.1.20], putative Get druggable targets OG5_127055 All targets in OG5_127055
Candida albicans cell wall mannoprotein glycosyl hydrolase whose expression increases in presence of galatose Get druggable targets OG5_127055 All targets in OG5_127055
Candida albicans closely related to C. albicans GCA1 cell wall mannoprotein glycosyl hydrolase Get druggable targets OG5_127055 All targets in OG5_127055
Echinococcus multilocularis lysosomal alpha glucosidase Get druggable targets OG5_127055 All targets in OG5_127055
Schistosoma mansoni aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania infantum aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma mansoni alpha-glucosidase Get druggable targets OG5_127055 All targets in OG5_127055
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum Aldehyde dehydrogenase X, mitochondrial precursor, putative Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus granulosus lysosomal alpha glucosidase Get druggable targets OG5_127055 All targets in OG5_127055
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Onchocerca volvulus Get druggable targets OG5_127055 All targets in OG5_127055
Schistosoma japonicum Lysosomal alpha-glucosidase precursor, putative Get druggable targets OG5_127055 All targets in OG5_127055
Candida albicans cell wall mannoprotein glycosyl hydrolase whose expression increases in presence of galatose Get druggable targets OG5_127055 All targets in OG5_127055
Schistosoma japonicum Lethal(3)malignant brain tumor-like 3 protein, putative Get druggable targets OG5_130415 All targets in OG5_130415
Echinococcus multilocularis endonuclease exonuclease phosphatase Get druggable targets OG5_130415 All targets in OG5_130415
Schistosoma japonicum Lethal(3)malignant brain tumor-like 4 protein, putative Get druggable targets OG5_130415 All targets in OG5_130415
Schistosoma mansoni hypothetical protein Get druggable targets OG5_130415 All targets in OG5_130415
Candida albicans Mitochondrial aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania mexicana aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania braziliensis aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium tuberculosis Probable aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Mycobacterium tuberculosis Succinate-semialdehyde dehydrogenase [NADP+] dependent (SSDH) GabD1 aldehyde dehydrogenase 1 family, member A1 501 aa 456 aa 33.3 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Entamoeba histolytica hypothetical protein 0.0035 0.0573 0.2176
Echinococcus granulosus thymidylate synthase 0.0106 0.2675 0.4227
Mycobacterium ulcerans thymidylate synthase 0.0106 0.2675 1
Trichomonas vaginalis esterase, putative 0.0041 0.0751 0.2856
Schistosoma mansoni eyes absent homolog 0.0089 0.2172 0.2162
Leishmania major alpha glucosidase II subunit, putative 0.0044 0.0821 0.2069
Schistosoma mansoni serine/threonine protein kinase 0.0104 0.2631 0.2622
Onchocerca volvulus 0.0114 0.2921 1
Schistosoma mansoni dihydrofolate reductase 0.0043 0.0803 0.0791
Loa Loa (eye worm) hypothetical protein 0.0058 0.1238 0.2291
Trypanosoma cruzi hypothetical protein, conserved 0.0044 0.0821 0.2069
Toxoplasma gondii bifunctional dihydrofolate reductase-thymidylate synthase 0.0149 0.3965 1
Onchocerca volvulus 0.0041 0.0751 0.2572
Trichomonas vaginalis D-aminoacylase, putative 0.0041 0.0751 0.2856
Entamoeba histolytica serine/threonine protein kinase, putative 0.0104 0.2631 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.1709 0.4977
Loa Loa (eye worm) hypothetical protein 0.0066 0.1477 0.2732
Echinococcus granulosus SAM and MBT domain containing protein 0.0058 0.1238 0.1945
Schistosoma mansoni alpha-glucosidase 0.0169 0.4585 0.4578
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0073 0.1709 0.1435
Echinococcus granulosus histone acetyltransferase KAT2B 0.0139 0.3662 0.5794
Echinococcus multilocularis lysosomal alpha glucosidase 0.0197 0.5405 0.8562
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0227 0.6311 1
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0073 0.1709 0.2693
Trichomonas vaginalis CAMK family protein kinase 0.0104 0.2631 1
Trichomonas vaginalis conserved hypothetical protein 0.005 0.1017 0.3867
Loa Loa (eye worm) hypothetical protein 0.0041 0.0751 0.139
Loa Loa (eye worm) hypothetical protein 0.0041 0.0751 0.139
Trichomonas vaginalis CAMK family protein kinase 0.0104 0.2631 1
Echinococcus multilocularis histone acetyltransferase MYST2 0.0066 0.1477 0.2325
Brugia malayi beta-lactamase family protein 0.0041 0.0751 0.139
Loa Loa (eye worm) hypothetical protein 0.0041 0.0751 0.139
Leishmania major dihydrofolate reductase-thymidylate synthase 0.0149 0.3965 1
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0044 0.0821 0.3118
Trypanosoma cruzi hypothetical protein, conserved 0.0041 0.0751 0.1895
Entamoeba histolytica hypothetical protein 0.0035 0.0573 0.2176
Brugia malayi acetyltransferase, GNAT family protein 0.0143 0.3782 0.6997
Trypanosoma cruzi dihydrofolate reductase-thymidylate synthase, putative 0.005 0.1017 0.2566
Schistosoma mansoni sex comb on midleg homolog 0.0058 0.1238 0.1227
Brugia malayi Dihydrofolate reductase 0.0043 0.0803 0.1485
Schistosoma mansoni hypothetical protein 0.0034 0.0517 0.0504
Trichomonas vaginalis alpha-glucosidase, putative 0.0044 0.0821 0.3118
Echinococcus multilocularis beta LACTamase domain containing family member 0.0041 0.0751 0.1173
Brugia malayi beta-lactamase 0.0041 0.0751 0.139
Loa Loa (eye worm) mbt repeat family protein 0.0058 0.1238 0.2291
Trichomonas vaginalis alpha-glucosidase, putative 0.0044 0.0821 0.3118
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0044 0.0821 0.3118
Entamoeba histolytica acetyltransferase, GNAT family 0.0038 0.0664 0.2523
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0073 0.1709 0.2693
Trichomonas vaginalis CAMK family protein kinase 0.0052 0.1057 0.4016
Entamoeba histolytica hypothetical protein 0.0035 0.0573 0.2176
Trichomonas vaginalis CAMK family protein kinase 0.0104 0.2631 1
Trypanosoma brucei hypothetical protein, conserved 0.0041 0.0751 0.1895
Mycobacterium tuberculosis Dihydrofolate reductase DfrA (DHFR) (tetrahydrofolate dehydrogenase) 0.0043 0.0803 0.0077
Echinococcus multilocularis polycomb protein SCMH1 0.0058 0.1238 0.1945
Loa Loa (eye worm) hypothetical protein 0.0049 0.0981 0.1815
Brugia malayi serine/threonine-protein kinase plk-2 0.0104 0.2631 0.4868
Loa Loa (eye worm) beta-lactamase 0.0041 0.0751 0.139
Trichomonas vaginalis alpha-glucosidase, putative 0.0044 0.0821 0.3118
Echinococcus granulosus polycomb protein SCMH1 0.0058 0.1238 0.1945
Loa Loa (eye worm) hypothetical protein 0.0089 0.2172 0.4018
Toxoplasma gondii aldehyde dehydrogenase 0.0073 0.1709 0.298
Loa Loa (eye worm) hypothetical protein 0.0034 0.0517 0.0956
Trichomonas vaginalis alpha-glucosidase, putative 0.0044 0.0821 0.3118
Echinococcus multilocularis SAM and MBT domain containing protein 0.0058 0.1238 0.1945
Schistosoma mansoni sex comb on midleg homolog 0.0058 0.1238 0.1227
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0066 0.1477 0.2325
Trichomonas vaginalis CAMK family protein kinase 0.0104 0.2631 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.0981 0.1815
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0104 0.2631 0.6636
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0066 0.1477 0.2325
Schistosoma mansoni alpha-glucosidase 0.0169 0.4585 0.4578
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0104 0.2631 0.4157
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0197 0.5405 1
Brugia malayi hypothetical protein 0.005 0.1017 0.1882
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0049 0.0981 0.1815
Echinococcus granulosus lysosomal alpha glucosidase 0.0197 0.5405 0.8562
Trichomonas vaginalis penicillin-binding protein, putative 0.0041 0.0751 0.2856
Echinococcus multilocularis dihydrofolate reductase 0.0043 0.0803 0.1254
Echinococcus granulosus beta LACTamase domain containing family member 0.0041 0.0751 0.1173
Onchocerca volvulus 0.0106 0.2675 0.9159
Trypanosoma brucei polo-like protein kinase 0.0104 0.2631 0.6636
Trypanosoma cruzi hypothetical protein, conserved 0.0041 0.0751 0.1895
Brugia malayi Glycosyl hydrolases family 31 protein 0.0197 0.5405 1
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0104 0.2631 0.4868
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0143 0.3782 0.5984
Onchocerca volvulus Serine\/threonine kinase homolog 0.0104 0.2631 0.9008
Chlamydia trachomatis dihydrofolate reductase 0.0043 0.0803 0.5
Trypanosoma cruzi polo-like protein kinase, putative 0.0104 0.2631 0.6636
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0041 0.0751 0.0739
Plasmodium vivax bifunctional dihydrofolate reductase-thymidylate synthase, putative 0.0149 0.3965 1
Echinococcus granulosus neutral alpha glucosidase AB 0.0044 0.0821 0.1282
Brugia malayi mbt repeat family protein 0.0058 0.1238 0.2291
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.1709 0.4977
Echinococcus granulosus dihydrofolate reductase 0.0043 0.0803 0.1254
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0058 0.1238 0.1227
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.1709 0.1698
Brugia malayi mbt repeat family protein 0.0058 0.1238 0.2291
Schistosoma mansoni bifunctional dihydrofolate reductase-thymidylate synthase 0.0106 0.2675 0.2666
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0042 0.0768 0.0053
Brugia malayi dihydrofolate reductase family protein 0.0043 0.0803 0.1485
Leishmania major hypothetical protein, conserved 0.0041 0.0751 0.1895
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0042 0.0768 0.0053
Trypanosoma cruzi polo-like protein kinase, putative 0.0104 0.2631 0.6636
Entamoeba histolytica hypothetical protein 0.0035 0.0573 0.2176
Brugia malayi SRC-1 0.0017 0.0013 0.0024
Trypanosoma brucei dihydrofolate reductase-thymidylate synthase 0.0149 0.3965 1
Echinococcus granulosus tyrosine protein kinase Lyn 0.0017 0.0023 0.0016
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.0573 0.0889
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.0981 0.1815
Trichomonas vaginalis alpha-glucosidase, putative 0.0044 0.0821 0.3118
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0073 0.1709 0.431
Loa Loa (eye worm) SRC-1 0.0017 0.0013 0.0024
Trichomonas vaginalis D-aminoacylase, putative 0.0041 0.0751 0.2856
Loa Loa (eye worm) MBCTL1 0.0066 0.1477 0.2732
Brugia malayi hypothetical protein 0.0035 0.0573 0.1059
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0066 0.1477 0.2732
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0042 0.0768 0.292
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0227 0.6311 1
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.0573 0.056
Brugia malayi thymidylate synthase 0.0106 0.2675 0.495
Loa Loa (eye worm) hypothetical protein 0.0041 0.0751 0.139
Mycobacterium leprae PROBABLE THYMIDYLATE SYNTHASE THYA (TS) (TSASE) 0.0106 0.2675 1
Trichomonas vaginalis D-aminoacylase, putative 0.0041 0.0751 0.2856
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0044 0.0821 0.3118
Onchocerca volvulus 0.0058 0.1238 0.4239
Echinococcus multilocularis thymidylate synthase 0.0106 0.2675 0.4227
Plasmodium falciparum bifunctional dihydrofolate reductase-thymidylate synthase 0.0149 0.3965 1
Trypanosoma cruzi dihydrofolate reductase-thymidylate synthase 0.0149 0.3965 1
Loa Loa (eye worm) hypothetical protein 0.0041 0.0751 0.139
Echinococcus multilocularis lysosomal alpha glucosidase 0.0197 0.5405 0.8562
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0058 0.1238 0.4239
Schistosoma mansoni kinase 0.0053 0.1098 0.1086
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0041 0.0751 0.139
Brugia malayi hypothetical protein 0.0089 0.2172 0.4018
Loa Loa (eye worm) hypothetical protein 0.0089 0.2172 0.4018
Trichomonas vaginalis maltase-glucoamylase, putative 0.0044 0.0821 0.3118
Mycobacterium tuberculosis Hypothetical protein 0.005 0.1017 0.0399
Brugia malayi Glycosyl hydrolases family 31 protein 0.0044 0.0821 0.1518
Schistosoma mansoni hypothetical protein 0.0035 0.0573 0.056
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0041 0.0751 0.0739
Loa Loa (eye worm) hypothetical protein 0.0041 0.0751 0.139
Giardia lamblia Kinase, PLK 0.0104 0.2631 1
Mycobacterium leprae DIHYDROFOLATE REDUCTASE DFRA (DHFR) (TETRAHYDROFOLATE DEHYDROGENASE) 0.0043 0.0803 0.0266
Echinococcus multilocularis neutral alpha glucosidase AB 0.0044 0.0821 0.1282
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0042 0.0768 0.0053
Trichomonas vaginalis penicillin-binding protein, putative 0.0041 0.0751 0.2856
Mycobacterium tuberculosis Probable thymidylate synthase ThyA (ts) (TSASE) 0.0106 0.2675 0.2883
Trichomonas vaginalis CAMK family protein kinase 0.0104 0.2631 1
Loa Loa (eye worm) acetyltransferase 0.0143 0.3782 0.6997
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0104 0.2631 0.4157
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0044 0.0821 0.3118
Trichomonas vaginalis bromodomain-containing protein, putative 0.0042 0.0768 0.292
Loa Loa (eye worm) dihydrofolate reductase 0.0043 0.0803 0.1485
Brugia malayi beta-lactamase family protein 0.0041 0.0751 0.139
Trypanosoma cruzi hypothetical protein, conserved 0.0044 0.0821 0.2069
Mycobacterium ulcerans dihydrofolate reductase DfrA 0.0043 0.0803 0.0266
Trichomonas vaginalis sucrase-isomaltase, putative 0.0044 0.0821 0.3118
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0264 0.7425 1
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0143 0.3782 0.3774
Trichomonas vaginalis CAMK family protein kinase 0.0104 0.2631 1
Schistosoma mansoni myelin transcription factor 1 myt1 0.0066 0.1477 0.1466
Trichomonas vaginalis CAMK family protein kinase 0.0052 0.1057 0.4016
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0044 0.0821 0.1518
Brugia malayi Tyrosine-protein kinase abl-1 0.0017 0.0013 0.0024
Loa Loa (eye worm) thymidylate synthase 0.0106 0.2675 0.495
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0044 0.0821 0.0215
Trichomonas vaginalis CAMK family protein kinase 0.0104 0.2631 1
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0517 0.0956
Trypanosoma brucei glucosidase, putative 0.0044 0.0821 0.2069
Schistosoma mansoni alpha glucosidase 0.0044 0.0821 0.0809
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.0573 0.0889
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0041 0.0751 0.139
Onchocerca volvulus 0.0041 0.0751 0.2572
Echinococcus granulosus histone acetyltransferase KAT2B 0.0042 0.0768 0.12
Onchocerca volvulus 0.0041 0.0751 0.2572
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.1709 0.1698
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.1709 0.4977
Echinococcus granulosus histone acetyltransferase MYST2 0.0066 0.1477 0.2325

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 10 um PUBCHEM_BIOASSAY: qHTS Assay for the Inhibitors of L3MBTL1. (Class of assay: confirmatory) [Related pubchem assays: 485292 (Probe Development Summary for Inhibitors of L3MBTL1)] ChEMBL. No reference
Potency (functional) = 12.5893 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) = 19.9526 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors and Activators of Human alpha-Glucosidase Cleavage of Glycogen. (Class of assay: confirmatory) [Related pubchem assays: 1473, 1466 ] ChEMBL. No reference
Potency (binding) = 25.1189 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) 26.8545 uM PUBCHEM_BIOASSAY: qHTS profiling assay for firefly luciferase inhibitor/activator using purified enzyme and Km concentrations of substrates (counterscreen for miR-21 project). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2288, AID2289, AID2598, AID411] ChEMBL. No reference
Potency (functional) = 39.8107 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human Jumonji Domain Containing 2E (JMJD2E). (Class of assay: confirmatory) ChEMBL. No reference

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.
 
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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.