Detailed information for compound 1391663

Basic information

Technical information
  • TDR Targets ID: 1391663
  • Name: 1-(2,4-dichlorophenyl)-3-phenyl-2-(1,2,4-tria zol-1-yl)prop-2-en-1-one
  • MW: 344.195 | Formula: C17H11Cl2N3O
  • H donors: 0 H acceptors: 3 LogP: 4.9 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccc(c(c1)Cl)C(=O)/C(=C/c1ccccc1)/n1cncn1
  • InChi: 1S/C17H11Cl2N3O/c18-13-6-7-14(15(19)9-13)17(23)16(22-11-20-10-21-22)8-12-4-2-1-3-5-12/h1-11H/b16-8-
  • InChiKey: ASQNXHPXQLGCKW-PXNMLYILSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • (Z)-1-(2,4-dichlorophenyl)-3-phenyl-2-(1,2,4-triazol-1-yl)prop-2-en-1-one
  • 1-(2,4-Dichloro-phenyl)-3-phenyl-2-[1,2,4]triazol-1-yl-propenone
  • BAS 00665638
  • A1096/0051481
  • MLS000566892
  • SMR000175751
  • ZINC04258305

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Influenza A virus Nonstructural protein 1 Starlite/ChEMBL No references
Homo sapiens polo-like kinase 1 Starlite/ChEMBL No references
Homo sapiens TAR DNA binding protein Starlite/ChEMBL No references
Homo sapiens GNAS complex locus Starlite/ChEMBL No references
Homo sapiens hepatocyte nuclear factor 4, alpha Starlite/ChEMBL No references
Homo sapiens vitamin D (1,25- dihydroxyvitamin D3) receptor Starlite/ChEMBL No references
Homo sapiens SMAD family member 2 Starlite/ChEMBL No references
Homo sapiens perilipin 1 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Loa Loa (eye worm) RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 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
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain Get druggable targets OG5_131088 All targets in OG5_131088
Trypanosoma cruzi polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Loa Loa (eye worm) transcription factor SMAD2 Get druggable targets OG5_131716 All targets in OG5_131716
Brugia malayi Nuclear hormone receptor family member nhr-49 Get druggable targets OG5_131038 All targets in OG5_131038
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) Get druggable targets OG5_131038 All targets in OG5_131038
Trypanosoma brucei polo-like protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
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 japonicum ko:K06631 polo-like kinase 1, putative Get druggable targets OG5_127396 All targets in OG5_127396
Brugia malayi RNA recognition motif domain containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative Get druggable targets OG5_131088 All targets in OG5_131088
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 Get druggable targets OG5_131038 All targets in OG5_131038
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus granulosus hepatocyte nuclear factor 4 alpha Get druggable targets OG5_131038 All targets in OG5_131038
Schistosoma japonicum Transcription factor HNF-4 homolog, putative Get druggable targets OG5_131038 All targets in OG5_131038
Brugia malayi MH2 domain containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Loa Loa (eye worm) TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Echinococcus multilocularis serine:threonine protein kinase PLK1 Get druggable targets OG5_127396 All targets in OG5_127396
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Schistosoma japonicum Serine/threonine-protein kinase PLK1, putative Get druggable targets OG5_127396 All targets in OG5_127396
Leishmania braziliensis protein kinase, putative,polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Brugia malayi TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Trypanosoma brucei gambiense polo-like protein kinase,protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative Get druggable targets OG5_131088 All targets in OG5_131088
Onchocerca volvulus Serine\/threonine kinase homolog Get druggable targets OG5_127396 All targets in OG5_127396
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
Trypanosoma cruzi polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
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
Loa Loa (eye worm) PLK/PLK1 protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Echinococcus granulosus tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni serine/threonine protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Candida albicans protein serine/threonine kinase Get druggable targets OG5_127396 All targets in OG5_127396
Schistosoma japonicum Hepatocyte nuclear factor 4-beta, putative Get druggable targets OG5_131038 All targets in OG5_131038
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
Trypanosoma congolense protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Leishmania infantum protein kinase, putative,polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Brugia malayi serine/threonine-protein kinase plk-2 Get druggable targets OG5_127396 All targets in OG5_127396
Leishmania mexicana protein kinase, putative,polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Echinococcus granulosus serine:threonine protein kinase PLK1 Get druggable targets OG5_127396 All targets in OG5_127396
Echinococcus multilocularis tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha Get druggable targets OG5_131038 All targets in OG5_131038
Candida albicans protein serine/threonine kinase Get druggable targets OG5_127396 All targets in OG5_127396
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
Giardia lamblia Kinase, PLK Get druggable targets OG5_127396 All targets in OG5_127396
Loa Loa (eye worm) MH2 domain-containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Leishmania major protein kinase, putative,polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Entamoeba histolytica serine/threonine protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi steroid hormone receptor vitamin D (1,25- dihydroxyvitamin D3) receptor 427 aa 416 aa 24.5 %
Brugia malayi MH2 domain containing protein SMAD family member 2 467 aa 405 aa 31.6 %
Schistosoma mansoni GTP-binding protein alpha subunit gna GNAS complex locus 394 aa 450 aa 28.7 %
Mycobacterium tuberculosis Hypothetical protein Nonstructural protein 1   230 aa 202 aa 23.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni nuclear receptor 0.0058 0.0006 0.0037
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0173 0.1303 0.1298
Brugia malayi photoreceptor-specific nuclear receptor 0.0173 0.1303 0.1298
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0303 0.2767 1
Echinococcus multilocularis tar DNA binding protein 0.0076 0.0209 0.0738
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0173 0.1303 0.1298
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0114 0.0634 0.2276
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0115 0.0642 0.2304
Echinococcus multilocularis ecdysone induced protein 78C 0.0173 0.1303 0.4697
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0173 0.1303 0.4697
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.0634 0.5
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.0634 0.5
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0173 0.1303 0.8861
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0173 0.1303 0.1298
Trypanosoma brucei polo-like protein kinase 0.0114 0.0634 0.5
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0173 0.1303 0.1298
Brugia malayi TAR-binding protein 0.0076 0.0209 0.0204
Brugia malayi hypothetical protein 0.0115 0.0642 0.0637
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0173 0.1303 0.1298
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0173 0.1303 0.1298
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0115 0.0642 0.0637
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0173 0.1303 0.1298
Trypanosoma cruzi polo-like protein kinase, putative 0.0114 0.0634 0.5
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0115 0.0642 0.2304
Loa Loa (eye worm) MH2 domain-containing protein 0.0144 0.0974 0.0969
Schistosoma mansoni nuclear receptor nhr-48 0.0058 0.0006 0.0037
Brugia malayi Steroid receptor seven-up type 2 0.0173 0.1303 0.1298
Loa Loa (eye worm) TAR-binding protein 0.0076 0.0209 0.0204
Echinococcus multilocularis FTZ F1 alpha 0.0173 0.1303 0.4697
Echinococcus granulosus tar DNA binding protein 0.0076 0.0209 0.0738
Schistosoma mansoni nuclear hormone receptor 0.0058 0.0006 0.0037
Loa Loa (eye worm) hypothetical protein 0.0173 0.1303 0.1298
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0173 0.1303 0.1298
Echinococcus granulosus ecdysone induced protein 78C 0.0173 0.1303 0.4697
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0173 0.1303 0.4697
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0114 0.0634 0.0629
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.0634 0.5
Brugia malayi hypothetical protein 0.0115 0.0642 0.0637
Brugia malayi RNA binding protein 0.0076 0.0209 0.0204
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.0634 0.5
Loa Loa (eye worm) hypothetical protein 0.0115 0.0642 0.0637
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0173 0.1303 0.1298
Onchocerca volvulus Bile acid receptor homolog 0.0943 1 1
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0188 0.147 1
Loa Loa (eye worm) transcription factor SMAD2 0.0144 0.0974 0.0969
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0173 0.1303 0.4697
Giardia lamblia Kinase, PLK 0.0114 0.0634 0.5
Brugia malayi RNA recognition motif domain containing protein 0.0076 0.0209 0.0204
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0173 0.1303 0.1298
Schistosoma mansoni nuclear hormone receptor 0.0058 0.0006 0.0037
Schistosoma mansoni tar DNA-binding protein 0.0076 0.0209 0.1424
Loa Loa (eye worm) hypothetical protein 0.0115 0.0642 0.0637
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0173 0.1303 0.4697
Loa Loa (eye worm) hypothetical protein 0.0115 0.0642 0.0637
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0115 0.0642 0.4365
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0303 0.2767 1
Schistosoma mansoni retinoic acid receptor RXR 0.0173 0.1303 0.8861
Brugia malayi MH2 domain containing protein 0.0144 0.0974 0.0969
Schistosoma mansoni tar DNA-binding protein 0.0076 0.0209 0.1424
Schistosoma mansoni tar DNA-binding protein 0.0076 0.0209 0.1424
Onchocerca volvulus Serine\/threonine kinase homolog 0.0114 0.0634 0.0629
Loa Loa (eye worm) hypothetical protein 0.0173 0.1303 0.1298
Brugia malayi nuclear receptor NHR-88 0.0173 0.1303 0.1298
Brugia malayi Nuclear hormone receptor-like 1 0.0115 0.0642 0.0637
Loa Loa (eye worm) hypothetical protein 0.0173 0.1303 0.1298
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0173 0.1303 0.8861
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0058 0.0006 0.0037
Loa Loa (eye worm) hypothetical protein 0.0173 0.1303 0.1298
Schistosoma mansoni nuclear receptor 0.0058 0.0006 0.0037
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0173 0.1303 0.1298
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0173 0.1303 0.8861
Echinococcus granulosus thyroid hormone receptor alpha 0.0197 0.157 0.5664
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0076 0.0209 0.0204
Mycobacterium tuberculosis Probable oxidoreductase 0.0839 0.8828 0.5
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0173 0.1303 0.4697
Echinococcus granulosus FTZ F1 alpha 0.0173 0.1303 0.4697
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0173 0.1303 0.1298
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0173 0.1303 0.8861
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0303 0.2767 0.2763
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0173 0.1303 0.1298
Loa Loa (eye worm) hypothetical protein 0.0115 0.0642 0.0637
Entamoeba histolytica serine/threonine protein kinase, putative 0.0114 0.0634 0.5
Brugia malayi Nuclear hormone receptor-like 1 0.0173 0.1303 0.1298
Brugia malayi Nuclear hormone receptor-like 1 0.0115 0.0642 0.0637
Schistosoma mansoni thyroid hormone receptor 0.0173 0.1303 0.8861
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0173 0.1303 0.4697
Schistosoma mansoni serine/threonine protein kinase 0.0114 0.0634 0.4314
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0173 0.1303 0.1298
Brugia malayi nuclear receptor RXR 0.0115 0.0642 0.0637
Onchocerca volvulus Protein ultraspiracle homolog 0.0173 0.1303 0.1298
Schistosoma mansoni coup transcription factor 0.0173 0.1303 0.8861
Onchocerca volvulus 0.0173 0.1303 0.1298
Trypanosoma cruzi polo-like protein kinase, putative 0.0114 0.0634 0.5
Schistosoma mansoni steroid hormone receptor ad4bp 0.0173 0.1303 0.8861
Brugia malayi steroid hormone receptor 0.0312 0.2867 0.2863
Loa Loa (eye worm) RNA binding protein 0.0076 0.0209 0.0204
Loa Loa (eye worm) hypothetical protein 0.0943 1 1
Echinococcus multilocularis thyroid hormone receptor alpha 0.0173 0.1303 0.4697
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0173 0.1303 0.1298
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0173 0.1303 0.8861
Brugia malayi serine/threonine-protein kinase plk-2 0.0114 0.0634 0.0629
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.0634 0.5
Loa Loa (eye worm) hypothetical protein 0.0173 0.1303 0.1298
Schistosoma mansoni zinc finger protein 0.0058 0.0006 0.0037
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0173 0.1303 0.1298
Schistosoma mansoni tar DNA-binding protein 0.0076 0.0209 0.1424
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0115 0.0642 0.4365
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0173 0.1303 0.4697
Loa Loa (eye worm) steroid hormone receptor 0.0312 0.2867 0.2863
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0173 0.1303 0.1298
Mycobacterium ulcerans short chain dehydrogenase 0.0839 0.8828 0.5
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0173 0.1303 0.4697
Schistosoma mansoni RAR-like nuclear receptor 0.0173 0.1303 0.8861
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0173 0.1303 0.4697
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0114 0.0634 0.5
Brugia malayi nuclear hormone receptor 0.0173 0.1303 0.1298
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0173 0.1303 0.1298
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0173 0.1303 0.4697
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0303 0.2767 0.2763
Schistosoma mansoni nuclear hormone receptor 0.0173 0.1303 0.8861
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.0634 0.5
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0173 0.1303 0.4697
Schistosoma mansoni tar DNA-binding protein 0.0076 0.0209 0.1424
Loa Loa (eye worm) hypothetical protein 0.0173 0.1303 0.1298
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.0634 0.5
Loa Loa (eye worm) hypothetical protein 0.0115 0.0642 0.0637
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0173 0.1303 0.8861
Schistosoma mansoni thyroid hormone receptor 0.0173 0.1303 0.8861
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0114 0.0634 0.2276
Loa Loa (eye worm) hypothetical protein 0.0173 0.1303 0.1298
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0173 0.1303 0.1298

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) 2.3 uM PubChem BioAssay. Counterscreen for inhibitors of the interaction of the lipase co-activator protein, abhydrolase domain containing 5 (ABHD5) with perilipin-5 (MLDP; PLIN5): Luminescence-based biochemical high throughput dose response assay to identify inhibitors of the interaction of the lipase co-activator protein, abhydrolase domain containing 5 (ABHD5) with perilipin-1 (PLIN1). (Class of assay: confirmatory) ChEMBL. No reference
IC50 (functional) 3.223 uM PubChem BioAssay. Counterscreen for inhibitors of the interaction of the lipase co-activator protein, abhydrolase domain containing 5 (ABHD5) with perilipin-5 (MLDP; PLIN5): Luminescence-based biochemical high throughput dose response assay to identify inhibitors of Hepatocyte nuclear factor 4 (HNF4) dimerization. (Class of assay: confirmatory) ChEMBL. No reference
IC50 (functional) 149.7 uM PubChem BioAssay. Discovery of small molecule inhibitors of the oncogenic and cytokinetic protein MgcRacGAP - Primary and Confirmatory Screens. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 0.7375 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) 1.7783 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) 3.5481 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 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Influenza NS1 Protein Function. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 11.2202 uM PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 18.8876 uM PubChem BioAssay. qHTS for Inhibitors of PLK1-PDB (polo-like kinase 1 - polo-box domain): Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 19.9526 uM PUBCHEM_BIOASSAY: Inhibitors of the vitamin D receptor (VDR): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504855] ChEMBL. No reference
Potency (functional) 20.5962 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in MCF 10a normal breast cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 23.1093 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in SW480 colon adenocarcinoma cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: VP16 counterscreen qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 35.4813 uM PubChem BioAssay. qHTS of alpha-syn Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 39.8107 um PUBCHEM_BIOASSAY: qHTS Assay for Promiscuous and Specific Inhibitors of Cruzain (without detergent). (Class of assay: confirmatory) [Related pubchem assays: 2158 (Confirmation qHTS Assay for Inhibitors of Cruzain), 2249 (Probe Development Summary of Promiscuous Inhibitors (Artifacts) of Cruzain), 2161 (qHTS Assay for Inhibitors of Papain: Counterscreen for Cruzain Assay), 1478 (qHTS Assay for Promiscuous and Specific Inhibitors of Cruzain (with detergent))] ChEMBL. No reference
Potency (functional) 39.8107 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Mammalian Selenoprotein Thioredoxin Reductase 1 (TrxR1): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488771] 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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