Detailed information for compound 1288935

Basic information

Technical information
  • TDR Targets ID: 1288935
  • Name: 2-[2-(4-chlorophenyl)ethenyl]-3-(2-hydroxyeth yl)quinazolin-4-one
  • MW: 326.777 | Formula: C18H15ClN2O2
  • H donors: 1 H acceptors: 2 LogP: 2.9 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: OCCn1c(/C=C/c2ccc(cc2)Cl)nc2c(c1=O)cccc2
  • InChi: 1S/C18H15ClN2O2/c19-14-8-5-13(6-9-14)7-10-17-20-16-4-2-1-3-15(16)18(23)21(17)11-12-22/h1-10,22H,11-12H2/b10-7+
  • InChiKey: YJXCBDMPFWBUKG-JXMROGBWSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-[(E)-2-(4-chlorophenyl)ethenyl]-3-(2-hydroxyethyl)quinazolin-4-one
  • 2-[2-(4-chlorophenyl)vinyl]-3-(2-hydroxyethyl)quinazolin-4-one
  • 2-[(E)-2-(4-chlorophenyl)vinyl]-3-(2-hydroxyethyl)quinazolin-4-one
  • 2-[2-(4-chlorophenyl)vinyl]-3-(2-hydroxyethyl)-4-quinazolinone
  • 2-[(E)-2-(4-chlorophenyl)vinyl]-3-(2-hydroxyethyl)-4-quinazolinone
  • STOCK3S-21289
  • 2-[2-(4-Chloro-phenyl)-vinyl]-3-(2-hydroxy-ethyl)-3H-quinazolin-4-one
  • BAS 04056250
  • ZINC04844539

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens TAR DNA binding protein Starlite/ChEMBL No references
Homo sapiens geminin, DNA replication inhibitor Starlite/ChEMBL No references
Homo sapiens glucagon-like peptide 1 receptor Starlite/ChEMBL No references
Mus musculus RAR-related orphan receptor gamma Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing 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
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus multilocularis tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi RNA recognition motif domain containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus granulosus tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) TAR-binding 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
Brugia malayi 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
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Loa Loa (eye worm) pigment dispersing factor receptor c glucagon-like peptide 1 receptor 463 aa 388 aa 25.8 %
Brugia malayi Hypothetical 65.5 kDa Trp-Asp repeats containing protein F02E8.5 inchromosome X geminin, DNA replication inhibitor 209 aa 176 aa 27.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus granulosus dna polymerase kappa 0.0021 0.0483 0.0566
Brugia malayi nuclear hormone receptor 0.0012 0.0187 0.0781
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0021 0.0462 0.9262
Trypanosoma brucei DNA polymerase IV, putative 0.0021 0.0483 0.3432
Echinococcus granulosus tar DNA binding protein 0.0076 0.2316 0.3411
Schistosoma mansoni sex comb on midleg homolog 0.005 0.1441 0.1441
Schistosoma mansoni hypothetical protein 0.0022 0.05 0.05
Schistosoma mansoni tar DNA-binding protein 0.0076 0.2316 0.2316
Schistosoma mansoni hypothetical protein 0.0205 0.6561 0.6561
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0035 0.0925 0.8232
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0038 0.1034 0.0782
Echinococcus multilocularis SAM and MBT domain containing protein 0.005 0.1441 0.2051
Schistosoma mansoni nuclear hormone receptor 0.0012 0.0187 0.0187
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0021 0.0462 0.1189
Schistosoma mansoni retinoic acid receptor RXR 0.0012 0.0187 0.0187
Brugia malayi RNA recognition motif domain containing protein 0.0076 0.2316 0.9693
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0012 0.0187 0.0187
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.005 0.1444 0.2057
Loa Loa (eye worm) hypothetical protein 0.0045 0.1265 0.3253
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0018 0.0375 0.0375
Loa Loa (eye worm) hypothetical protein 0.0012 0.0187 0.048
Echinococcus granulosus fetal alzheimer antigen falz 0.0024 0.0566 0.0694
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.005 0.1444 0.1444
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0038 0.1032 0.1416
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0012 0.0187 0.0781
Mycobacterium ulcerans beta-lactamase 0.0038 0.1034 0.9199
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0018 0.0375 0.0398
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0021 0.0462 0.0533
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0063 0.1858 0.2699
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.005 0.1444 0.2057
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0021 0.0462 0.0533
Schistosoma mansoni inositol monophosphatase 0.0041 0.1124 0.1124
Leishmania major hypothetical protein, conserved 0.0016 0.0314 0.2231
Loa Loa (eye worm) steroid hormone receptor 0.0012 0.0187 0.048
Loa Loa (eye worm) RecQ helicase 0.0025 0.0598 0.1538
Schistosoma mansoni steroid hormone receptor ad4bp 0.0012 0.0187 0.0187
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0012 0.0187 0.0187
Mycobacterium ulcerans DNA polymerase IV 0.0021 0.0483 0.4301
Trypanosoma brucei unspecified product 0.0015 0.0266 0.1887
Echinococcus granulosus histone acetyltransferase MYST2 0.0057 0.167 0.2408
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0483 0.3432
Trypanosoma brucei DNA polymerase IV, putative 0.0021 0.0483 0.3432
Leishmania major DNA polymerase kappa, putative 0.0021 0.0483 0.3432
Echinococcus granulosus SAM and MBT domain containing protein 0.005 0.1441 0.2051
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0022 0.0499 1
Brugia malayi Nuclear hormone receptor-like 1 0.0012 0.0187 0.0781
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0019 0.0413 0.0457
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0012 0.0187 0.0105
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0012 0.0187 0.048
Loa Loa (eye worm) hypothetical protein 0.0038 0.1034 0.2659
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.001 0.0119 0.106
Mycobacterium ulcerans lipase LipD 0.0038 0.1034 0.9199
Echinococcus granulosus GPCR family 2 0.0019 0.0413 0.0457
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.005 0.1444 0.1444
Echinococcus multilocularis histone acetyltransferase MYST2 0.0057 0.167 0.2408
Loa Loa (eye worm) hypothetical protein 0.0019 0.0413 0.1063
Loa Loa (eye worm) hypothetical protein 0.0012 0.0187 0.048
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0038 0.1034 0.2659
Brugia malayi Steroid receptor seven-up type 2 0.0012 0.0187 0.0781
Loa Loa (eye worm) latrophilin receptor protein 2 0.0019 0.0413 0.1063
Onchocerca volvulus 0.0038 0.1034 0.6758
Brugia malayi Inositol-1 0.0041 0.1124 0.4704
Echinococcus granulosus inositol monophosphatase 1 0.0041 0.1124 0.156
Brugia malayi nuclear receptor NHR-88 0.0012 0.0187 0.0781
Schistosoma mansoni DNA helicase recq1 0.001 0.0119 0.0119
Giardia lamblia Sgs1 DNA helicase, putative 0.001 0.0119 0.2465
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0012 0.0187 0.0781
Brugia malayi PHD-finger family protein 0.0026 0.0648 0.2713
Trichomonas vaginalis penicillin-binding protein, putative 0.0038 0.1034 0.9007
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0483 0.3432
Schistosoma mansoni hypothetical protein 0.0019 0.0413 0.0413
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0012 0.0187 0.0105
Brugia malayi ImpB/MucB/SamB family protein 0.0049 0.1409 0.5895
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0021 0.0483 0.0566
Trypanosoma brucei hypothetical protein, conserved 0.0038 0.1034 0.734
Echinococcus granulosus histone lysine methyltransferase setb 0.0018 0.0375 0.0398
Mycobacterium tuberculosis Conserved protein 0.0038 0.1034 0.0782
Schistosoma mansoni bromodomain containing protein 0.0066 0.1982 0.1982
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0019 0.0413 0.0457
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0012 0.0187 0.048
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0483 0.3432
Loa Loa (eye worm) ATP-dependent DNA helicase 0.001 0.0119 0.0306
Echinococcus multilocularis GPCR, family 2 0.0019 0.0413 0.0457
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0012 0.0187 0.0781
Trypanosoma brucei DNA polymerase kappa, putative 0.0015 0.0266 0.1887
Brugia malayi Bloom's syndrome protein homolog 0.0025 0.0598 0.2503
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0038 0.1034 0.0782
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0021 0.0483 0.0483
Brugia malayi TAR-binding protein 0.0076 0.2316 0.9693
Loa Loa (eye worm) hypothetical protein 0.0038 0.1034 0.2659
Mycobacterium ulcerans esterase/lipase LipP 0.0038 0.1034 0.9199
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0012 0.0187 0.0781
Schistosoma mansoni tar DNA-binding protein 0.0076 0.2316 0.2316
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0012 0.0187 0.048
Brugia malayi ecdysteroid receptor 0.0012 0.0187 0.0781
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0012 0.0187 0.0781
Loa Loa (eye worm) hypothetical protein 0.0043 0.1199 0.3082
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0057 0.167 0.2408
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0483 0.3432
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0041 0.1124 0.7979
Schistosoma mansoni hypothetical protein 0.0205 0.6561 0.6561
Schistosoma mansoni hypothetical protein 0.0019 0.0413 0.0413
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.005 0.1444 0.3713
Mycobacterium tuberculosis Conserved hypothetical protein 0.0021 0.0483 0.0029
Brugia malayi beta-lactamase family protein 0.0038 0.1034 0.4327
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0021 0.0483 0.2928
Loa Loa (eye worm) hypothetical protein 0.0049 0.1409 0.3623
Brugia malayi mbt repeat family protein 0.005 0.1441 0.6029
Echinococcus multilocularis inositol monophosphatase 1 0.0041 0.1124 0.156
Brugia malayi photoreceptor-specific nuclear receptor 0.0012 0.0187 0.0781
Loa Loa (eye worm) RNA binding protein 0.0076 0.2316 0.5957
Schistosoma mansoni methyl-cpg binding protein mbd 0.0018 0.0375 0.0375
Mycobacterium tuberculosis Probable esterase LipL 0.0038 0.1034 0.0782
Schistosoma mansoni hypothetical protein 0.0019 0.0413 0.0413
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0012 0.0187 0.048
Leishmania major hypothetical protein, conserved 0.0038 0.1034 0.734
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0038 0.1034 0.1034
Echinococcus multilocularis dna polymerase kappa 0.0021 0.0483 0.0566
Loa Loa (eye worm) hypothetical protein 0.0038 0.1034 0.2659
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0041 0.1124 1
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0012 0.0187 0.0187
Trypanosoma cruzi ISWI complex protein 0.0016 0.0314 0.2231
Loa Loa (eye worm) hypothetical protein 0.0038 0.1034 0.2659
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0012 0.0187 0.0105
Schistosoma mansoni inositol monophosphatase 0.0041 0.1124 0.1124
Toxoplasma gondii ABC1 family protein 0.0038 0.1034 0.9199
Trichomonas vaginalis ap endonuclease, putative 0.0021 0.0462 0.2694
Loa Loa (eye worm) hypothetical protein 0.005 0.1441 0.3705
Loa Loa (eye worm) mbt repeat family protein 0.005 0.1441 0.3705
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0019 0.0413 0.173
Trypanosoma brucei ISWI complex protein 0.0016 0.0314 0.2231
Loa Loa (eye worm) bromodomain containing protein 0.0019 0.0397 0.102
Trypanosoma cruzi DNA polymerase eta, putative 0.0049 0.1409 1
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.005 0.1441 0.1441
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0041 0.1124 0.7979
Trichomonas vaginalis esterase, putative 0.0038 0.1034 0.9007
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.005 0.1444 0.2057
Brugia malayi RNA binding protein 0.0076 0.2316 0.9693
Schistosoma mansoni coup transcription factor 0.0012 0.0187 0.0187
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0012 0.0187 0.0105
Loa Loa (eye worm) hypothetical protein 0.0012 0.0187 0.048
Schistosoma mansoni terminal deoxycytidyl transferase 0.0021 0.0483 0.0483
Plasmodium falciparum ATP-dependent DNA helicase Q1 0.001 0.0119 0.2388
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0024 0.0566 0.0566
Echinococcus granulosus bloom syndrome protein 0.0025 0.0598 0.0744
Loa Loa (eye worm) hypothetical protein 0.0124 0.3888 1
Mycobacterium ulcerans hypothetical protein 0.0038 0.1034 0.9199
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0483 0.3432
Echinococcus multilocularis FTZ F1 alpha 0.0012 0.0187 0.0105
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.0036 0.0983 0.0712
Loa Loa (eye worm) hypothetical protein 0.0012 0.0187 0.048
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0021 0.0462 0.9561
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0012 0.0187 0.0781
Schistosoma mansoni thyroid hormone receptor 0.0012 0.0187 0.0187
Schistosoma mansoni hypothetical protein 0.0041 0.1146 0.1146
Loa Loa (eye worm) hypothetical protein 0.001 0.0119 0.0306
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0018 0.0375 0.0398
Onchocerca volvulus 0.0038 0.1034 0.6758
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0019 0.0413 0.0457
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0057 0.167 0.6989
Brugia malayi beta-lactamase family protein 0.0038 0.1034 0.4327
Schistosoma mansoni myelin transcription factor 1 myt1 0.0057 0.167 0.167
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0038 0.1032 0.1416
Mycobacterium leprae Probable lipase LipE 0.0038 0.1034 1
Loa Loa (eye worm) hypothetical protein 0.006 0.1777 0.4569
Loa Loa (eye worm) hypothetical protein 0.0012 0.0187 0.048
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0041 0.1124 1
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0041 0.1124 0.7979
Echinococcus granulosus ecdysone induced protein 78C 0.0012 0.0187 0.0105
Echinococcus granulosus dna polymerase eta 0.0049 0.1409 0.2002
Mycobacterium leprae conserved hypothetical protein 0.0038 0.1034 1
Echinococcus multilocularis thyroid hormone receptor alpha 0.0012 0.0187 0.0105
Trichomonas vaginalis DNA polymerase eta, putative 0.0021 0.0483 0.2928
Trichomonas vaginalis ap endonuclease, putative 0.0021 0.0462 0.2694
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0021 0.0483 0.3432
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0012 0.0187 0.0105
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0483 0.3432
Echinococcus granulosus geminin 0.0205 0.6561 1
Entamoeba histolytica deoxycytidyl transferase, putative 0.0021 0.0483 0.2928
Mycobacterium tuberculosis Conserved protein 0.0038 0.1034 0.0782
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.001 0.0119 0.0499
Mycobacterium ulcerans DNA polymerase IV 0.0021 0.0483 0.4301
Echinococcus multilocularis dna polymerase eta 0.0049 0.1409 0.2002
Trypanosoma cruzi DNA polymerase kappa, putative 0.0021 0.0483 0.3432
Mycobacterium tuberculosis Probable lipase LipD 0.0038 0.1034 0.0782
Schistosoma mansoni tar DNA-binding protein 0.0076 0.2316 0.2316
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.1777 0.7434
Toxoplasma gondii exonuclease III APE 0.0021 0.0462 0.4112
Loa Loa (eye worm) hypothetical protein 0.0041 0.1146 0.2946
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0021 0.0462 0.4112
Schistosoma mansoni blooms syndrome DNA helicase 0.0019 0.0427 0.0427
Loa Loa (eye worm) hypothetical protein 0.0074 0.2241 0.5763
Loa Loa (eye worm) PHD-finger family protein 0.0022 0.05 0.1285
Schistosoma mansoni zinc finger protein 0.0021 0.0463 0.0463
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.005 0.1444 0.6042
Echinococcus multilocularis zinc finger protein 0.0021 0.0463 0.0534
Brugia malayi beta-lactamase 0.0038 0.1034 0.4327
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0201 0.6454 0.9834
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0041 0.1124 1
Brugia malayi Latrophilin receptor protein 2 0.0019 0.0413 0.173
Loa Loa (eye worm) hypothetical protein 0.0012 0.0187 0.048
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0021 0.0483 0.0029
Loa Loa (eye worm) TAR-binding protein 0.0076 0.2316 0.5957
Brugia malayi steroid hormone receptor 0.0012 0.0187 0.0781
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0012 0.0187 0.0105
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0012 0.0187 0.0105
Loa Loa (eye worm) hypothetical protein 0.004 0.1116 0.2871
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.1034 0.9007
Loa Loa (eye worm) hypothetical protein 0.0038 0.1034 0.2659
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0012 0.0187 0.0187
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0021 0.0462 0.3281
Trichomonas vaginalis DNA helicase recq, putative 0.0025 0.0598 0.4194
Echinococcus multilocularis tar DNA binding protein 0.0076 0.2316 0.3411
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0021 0.0462 0.3281
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0012 0.0187 0.0781
Loa Loa (eye worm) hypothetical protein 0.0057 0.167 0.4295
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.1034 0.734
Loa Loa (eye worm) hypothetical protein 0.0038 0.1034 0.2659
Echinococcus granulosus beta LACTamase domain containing family member 0.0038 0.1034 0.142
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0012 0.0187 0.0105
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0483 0.3432
Schistosoma mansoni methyl-cpg binding protein mbd 0.0018 0.0375 0.0375
Schistosoma mansoni zinc finger protein 0.0016 0.0314 0.0314
Loa Loa (eye worm) hypothetical protein 0.0012 0.0187 0.048
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0038 0.1034 0.0782
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0012 0.0187 0.0187
Plasmodium vivax hypothetical protein, conserved 0.0038 0.1034 1
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0021 0.0462 0.2694
Loa Loa (eye worm) hypothetical protein 0.0012 0.0187 0.048
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.1034 0.9007
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0012 0.0187 0.0781
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative 0.0017 0.0334 0.323
Schistosoma mansoni tar DNA-binding protein 0.0076 0.2316 0.2316
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0241 0.7779 1
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0038 0.1034 0.9199
Schistosoma mansoni ap endonuclease 0.0021 0.0462 0.0462
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0016 0.0327 0.2913
Echinococcus granulosus methyl CpG binding domain protein 2 0.0018 0.0375 0.0398
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0012 0.0187 0.0105
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.1777 0.7434
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative 0.0013 0.0218 0.1549
Trypanosoma cruzi DNA polymerase kappa, putative 0.0021 0.0483 0.3432
Giardia lamblia DINP protein human, muc B family 0.0021 0.0483 1
Echinococcus granulosus FTZ F1 alpha 0.0012 0.0187 0.0105
Schistosoma mansoni hypothetical protein 0.0019 0.0413 0.0413
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0012 0.0187 0.0781
Brugia malayi ImpB/MucB/SamB family protein 0.0021 0.0483 0.2023
Loa Loa (eye worm) MBCTL1 0.0057 0.167 0.4295
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.1034 0.9007
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0012 0.0187 0.048
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0021 0.0483 0.1243
Trypanosoma brucei unspecified product 0.0015 0.0266 0.1887
Trichomonas vaginalis penicillin-binding protein, putative 0.0038 0.1034 0.9007
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0041 0.1124 1
Leishmania major DNA polymerase eta, putative 0.0049 0.1409 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0012 0.0187 0.0781
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.1034 0.734
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0063 0.1858 0.2699
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0012 0.0187 0.0105
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0021 0.0483 0.0566
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0483 0.3432
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0038 0.1034 0.1034
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.005 0.1441 1
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0012 0.0187 0.0105
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0483 0.3432
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.005 0.1444 0.2057
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0024 0.0566 0.0694
Schistosoma mansoni hypothetical protein 0.0016 0.0314 0.0314
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.001 0.0119 0.106
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0041 0.1124 1
Brugia malayi Bromodomain containing protein 0.0079 0.239 1
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0041 0.1124 0.7979
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0021 0.0462 0.3281
Brugia malayi exodeoxyribonuclease III family protein 0.0021 0.0462 0.1934
Echinococcus multilocularis polycomb protein SCMH1 0.005 0.1441 0.2051
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0201 0.6454 0.9834
Schistosoma mansoni tar DNA-binding protein 0.0076 0.2316 0.2316
Echinococcus granulosus polycomb protein SCMH1 0.005 0.1441 0.2051
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0012 0.0187 0.0187
Schistosoma mansoni thyroid hormone receptor 0.0012 0.0187 0.0187
Treponema pallidum exodeoxyribonuclease (exoA) 0.0021 0.0462 0.5
Echinococcus multilocularis bloom syndrome protein 0.0025 0.0598 0.0744
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.005 0.1444 0.1444
Schistosoma mansoni ap endonuclease 0.0021 0.0462 0.0462
Schistosoma mansoni DNA helicase recq5 0.001 0.0119 0.0119
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0038 0.1034 0.4327
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0076 0.2316 0.5957
Mycobacterium tuberculosis Probable hydrolase 0.0038 0.1034 0.0782
Trypanosoma cruzi DNA polymerase kappa, putative 0.0021 0.0483 0.3432
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0018 0.0375 0.0375
Trypanosoma cruzi DNA polymerase eta, putative 0.0035 0.0925 0.6568
Echinococcus multilocularis ecdysone induced protein 78C 0.0012 0.0187 0.0105
Brugia malayi Bromodomain containing protein 0.004 0.1114 0.4661
Trypanosoma brucei unspecified product 0.0021 0.0483 0.3432
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0483 0.3432
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0041 0.1124 1
Leishmania major DNA polymerase eta, putative 0.0035 0.0925 0.6568
Trypanosoma cruzi DNA polymerase kappa, putative 0.0021 0.0483 0.3432
Trypanosoma brucei DNA polymerase IV, putative 0.0021 0.0483 0.3432
Schistosoma mansoni DNA polymerase eta 0.0049 0.1409 0.1409
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0012 0.0187 0.0781
Trypanosoma brucei DNA polymerase kappa, putative 0.0015 0.0266 0.1887
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0021 0.0462 0.3281
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0012 0.0187 0.0105
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0019 0.0413 0.0457
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0057 0.167 0.2408
Onchocerca volvulus 0.0038 0.1034 0.6758
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0012 0.0187 0.048
Trypanosoma cruzi ISWI complex protein 0.0016 0.0314 0.2231
Mycobacterium tuberculosis Probable lipase LipE 0.0038 0.1034 0.0782
Schistosoma mansoni sex comb on midleg homolog 0.005 0.1441 0.1441
Trypanosoma brucei DNA polymerase kappa, putative 0.0015 0.0266 0.1887
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0021 0.0462 0.447
Mycobacterium tuberculosis Conserved protein 0.0038 0.1034 0.0782
Loa Loa (eye worm) inositol-1 0.0041 0.1124 0.2891
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.001 0.0119 0.0499
Trichomonas vaginalis DNA helicase recq1, putative 0.0025 0.0598 0.4194
Trypanosoma brucei DNA polymerase eta, putative 0.0049 0.1409 1
Onchocerca volvulus 0.005 0.1441 1
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0012 0.0187 0.0105
Echinococcus multilocularis beta LACTamase domain containing family member 0.0038 0.1034 0.142
Trichomonas vaginalis inositol monophosphatase, putative 0.0041 0.1124 1
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative 0.0013 0.0218 0.1549
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.1146 0.4794
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0012 0.0187 0.048
Loa Loa (eye worm) hypothetical protein 0.0018 0.0375 0.0965
Echinococcus multilocularis geminin 0.0205 0.6561 1
Echinococcus granulosus zinc finger protein 0.0021 0.0463 0.0534
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0012 0.0187 0.0781
Brugia malayi mbt repeat family protein 0.005 0.1441 0.6029
Schistosoma mansoni RAR-like nuclear receptor 0.0012 0.0187 0.0187
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.1777 0.4569
Loa Loa (eye worm) beta-lactamase 0.0038 0.1034 0.2659
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0012 0.0187 0.0781
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0013 0.0218 0.1549

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 5.1735 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) 8.9125 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (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) = 12.5893 um PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 16.5113 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) 25.1189 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249] ChEMBL. No reference
Potency (functional) 29.0929 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) 31.6228 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] ChEMBL. No reference
Potency (functional) 31.6228 uM PubChem BioAssay. qHTS Assay for Activators of ClpP. (Class of assay: confirmatory) ChEMBL. No reference
Potency (binding) 39.8107 uM PubChem BioAssay. qHTS Assay for Inhibitors of MBNL1-poly(CUG) RNA binding. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 70.7946 uM PUBCHEM_BIOASSAY: qHTS assay for re-activators of p53 using a Luc reporter. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504709] 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
Potency (functional) 100 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

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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