Detailed information for compound 1421163

Basic information

Technical information
  • TDR Targets ID: 1421163
  • Name: (5Z)-5-[(3-diethylaminopropylamino)methyliden e]-1-(2,3-dimethylphenyl)-1,3-diazinane-2,4,6 -trione
  • MW: 372.461 | Formula: C20H28N4O3
  • H donors: 2 H acceptors: 3 LogP: 3.25 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCN(CCCN/C=C\1/C(=O)NC(=O)N(C1=O)c1cccc(c1C)C)CC
  • InChi: 1S/C20H28N4O3/c1-5-23(6-2)12-8-11-21-13-16-18(25)22-20(27)24(19(16)26)17-10-7-9-14(3)15(17)4/h7,9-10,13,21H,5-6,8,11-12H2,1-4H3,(H,22,25,27)/b16-13-
  • InChiKey: WJIYJAHOQGLVHG-SSZFMOIBSA-N  


Substructure search Similarity search

Network

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Synonyms

  • (5Z)-5-[(3-diethylaminopropylamino)methylene]-1-(2,3-dimethylphenyl)hexahydropyrimidine-2,4,6-trione
  • (5Z)-5-[(3-diethylaminopropylamino)methylene]-1-(2,3-dimethylphenyl)barbituric acid
  • MLS000082039
  • SMR000046296

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens SMAD family member 2 Starlite/ChEMBL No references
Escherichia coli penicillin-binding protein Starlite/ChEMBL No references
Homo sapiens GNAS complex locus Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Mycobacterium tuberculosis Possible penicillin-binding protein Get druggable targets OG5_149948 All targets in OG5_149948
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Loa Loa (eye worm) MH2 domain-containing protein Get druggable targets OG5_131716 All targets in OG5_131716
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
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative Get druggable targets OG5_131088 All targets in OG5_131088
Brugia malayi MH2 domain containing protein Get druggable targets OG5_131716 All targets in OG5_131716
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) transcription factor SMAD2 Get druggable targets OG5_131716 All targets in OG5_131716
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
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 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Onchocerca volvulus 0.0291 0.3818 0.6267
Brugia malayi intermediate filament protein 0.0028 0.025 0.0378
Loa Loa (eye worm) hypothetical protein 0.0043 0.0457 0.0692
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0015 0.0075 0.0114
Echinococcus multilocularis cpg binding protein 0.0031 0.0283 0.0283
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.014 0.1767 0.2676
Loa Loa (eye worm) hypothetical protein 0.0043 0.0457 0.0692
Echinococcus multilocularis dnaJ subfamily B 0.0413 0.5475 0.5475
Mycobacterium leprae PROBABLE HYDROLASE 0.025 0.3261 1
Echinococcus multilocularis expressed protein 0.0361 0.4766 0.4766
Loa Loa (eye worm) hypothetical protein 0.0019 0.0118 0.0179
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0015 0.0075 0.0114
Schistosoma mansoni DNA polymerase eta 0.0019 0.012 0.0128
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.004 0.0413 0.0625
Echinococcus granulosus transcription factor Dp 1 0.0037 0.0368 0.0368
Echinococcus multilocularis beta LACTamase domain containing family member 0.0043 0.0457 0.0457
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0028 0.025 0.0378
Loa Loa (eye worm) transcription factor SMAD2 0.0144 0.1825 0.2763
Loa Loa (eye worm) matrixin family protein 0.0496 0.6605 1
Loa Loa (eye worm) hypothetical protein 0.0029 0.0267 0.0404
Brugia malayi RNA binding protein 0.0199 0.2571 0.3893
Echinococcus multilocularis sodium channel protein 0.0083 0.0995 0.0995
Loa Loa (eye worm) hypothetical protein 0.0055 0.0611 0.0925
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.0064 0.0733 0.0786
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.0019 0.0118 0.0127
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0019 0.012 0.012
Loa Loa (eye worm) hypothetical protein 0.0019 0.012 0.0181
Toxoplasma gondii ABC1 family protein 0.0043 0.0457 0.5944
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0043 0.0457 0.0958
Trichomonas vaginalis set domain proteins, putative 0.0229 0.2984 0.7018
Onchocerca volvulus 0.0048 0.0521 0.0746
Schistosoma mansoni matrix metallopeptidase-9 (M10 family) 0.0217 0.2808 0.301
Plasmodium falciparum flap endonuclease 1 0.0025 0.0208 0.5
Echinococcus multilocularis histone acetyltransferase MYST2 0.0055 0.0611 0.0611
Schistosoma mansoni lamin 0.0028 0.025 0.0267
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.014 0.1767 0.1767
Brugia malayi photoreceptor-specific nuclear receptor 0.0015 0.0075 0.0114
Echinococcus multilocularis FTZ F1 alpha 0.0015 0.0075 0.0075
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0019 0.012 0.012
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.0457 0.083
Echinococcus multilocularis regulator of G protein signaling 3 0.0019 0.0118 0.0118
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.014 0.1767 0.1894
Echinococcus granulosus tar DNA binding protein 0.0199 0.2571 0.2571
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.014 0.1767 0.1894
Echinococcus multilocularis regulator of G protein signaling 0.0019 0.0118 0.0118
Mycobacterium ulcerans hydrolase 0.025 0.3261 0.7695
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.012 0.1136
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0015 0.0075 0.0075
Loa Loa (eye worm) mbt repeat family protein 0.0048 0.0521 0.0788
Echinococcus granulosus beta LACTamase domain containing family member 0.0043 0.0457 0.0457
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative 0.004 0.0413 0.5372
Trichomonas vaginalis conserved hypothetical protein 0.004 0.0413 0.0722
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.012 0.1136
Leishmania major hypothetical protein, conserved 0.0043 0.0457 0.3855
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0015 0.0072 0.0109
Echinococcus multilocularis ubiquitin specific protease 41 0.004 0.0413 0.0413
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0015 0.0075 0.0114
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.0064 0.0733 0.111
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0043 0.0457 0.0827
Echinococcus granulosus ecdysone induced protein 78C 0.0015 0.0075 0.0075
Schistosoma mansoni hypothetical protein 0.018 0.231 0.2476
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 0.004 0.0413 0.0413
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0457 0.083
Loa Loa (eye worm) hypothetical protein 0.0043 0.0457 0.0692
Schistosoma mansoni microtubule-associated protein tau 0.0697 0.9329 1
Trypanosoma brucei unspecified product 0.0019 0.012 0.1136
Schistosoma mansoni axis inhibition protein axin 0.0019 0.0118 0.0127
Brugia malayi PXA domain containing protein 0.0019 0.0118 0.0179
Echinococcus multilocularis musashi 0.0028 0.025 0.025
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 0.004 0.0413 1
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.004 0.0413 0.0722
Brugia malayi Matrix metalloprotease, N-terminal domain containing protein 0.025 0.3261 0.4937
Brugia malayi A-kinase anchor protein 10, precursor 0.0019 0.0118 0.0179
Loa Loa (eye worm) hypothetical protein 0.0015 0.0075 0.0114
Schistosoma mansoni sex comb on midleg homolog 0.0048 0.0521 0.0558
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 0.004 0.0413 0.0413
Brugia malayi follicle stimulating hormone receptor 0.0226 0.2938 0.4447
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0055 0.0611 0.0925
Loa Loa (eye worm) hypothetical protein 0.0019 0.0118 0.0179
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.012 0.1136
Loa Loa (eye worm) beta-lactamase 0.0043 0.0457 0.0692
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0457 0.049
Schistosoma mansoni coup transcription factor 0.0015 0.0075 0.0081
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.019 0.2444 0.2444
Echinococcus granulosus beta-adrenergic receptor kinase 0.0019 0.0118 0.0118
Loa Loa (eye worm) MH2 domain-containing protein 0.0144 0.1825 0.2763
Brugia malayi Steroid receptor seven-up type 2 0.0015 0.0075 0.0114
Schistosoma mansoni myelin transcription factor 1 myt1 0.0055 0.0611 0.0655
Echinococcus granulosus polycomb protein SCMH1 0.0048 0.0521 0.0521
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.0457 0.083
Loa Loa (eye worm) hypothetical protein 0.025 0.3261 0.4937
Echinococcus granulosus regulator of G protein signaling 7 0.0019 0.0118 0.0118
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.001 0.0003 0.0003
Schistosoma mansoni nuclear hormone receptor 0.0015 0.0075 0.0081
Echinococcus multilocularis transcription factor Dp 1 0.0037 0.0368 0.0368
Loa Loa (eye worm) glutaminase 2 0.0319 0.4202 0.6361
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0267 0.0286
Brugia malayi Flap endonuclease-1 0.0025 0.0208 0.0315
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0015 0.0075 0.0075
Trypanosoma brucei DNA polymerase eta, putative 0.0019 0.012 0.1136
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.004 0.0413 0.4779
Echinococcus granulosus histone acetyltransferase MYST2 0.0055 0.0611 0.0611
Schistosoma mansoni regulator of G protein signaling 0.0019 0.0118 0.0127
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.012 0.1136
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0457 0.083
Mycobacterium tuberculosis Probable lipase LipD 0.0043 0.0457 0.0958
Schistosoma mansoni regulator of G protein signaling 0.0019 0.0118 0.0127
Echinococcus granulosus regulator of G protein signaling 3 0.0019 0.0118 0.0118
Schistosoma mansoni serine/threonine protein kinase 0.0019 0.0118 0.0127
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0267 0.0286
Echinococcus multilocularis matrix metallopeptidase 7 (M10 family) 0.0746 1 1
Echinococcus granulosus SAM and MBT domain containing protein 0.0048 0.0521 0.0521
Trichomonas vaginalis flap endonuclease-1, putative 0.0025 0.0208 0.0221
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.012 0.1136
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0015 0.0075 0.0081
Loa Loa (eye worm) hypothetical protein 0.0014 0.0051 0.0078
Brugia malayi glutaminase DH11.1 0.0319 0.4202 0.6361
Schistosoma mansoni flap endonuclease-1 0.0023 0.0176 0.0188
Loa Loa (eye worm) PXA domain-containing protein 0.0019 0.0118 0.0179
Brugia malayi Regulator of G protein signaling domain containing protein 0.0019 0.0118 0.0179
Schistosoma mansoni tar DNA-binding protein 0.0199 0.2571 0.2756
Onchocerca volvulus Matrilysin homolog 0.0455 0.6048 1
Loa Loa (eye worm) hypothetical protein 0.0306 0.403 0.6102
Brugia malayi steroid hormone receptor 0.0015 0.0075 0.0114
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0015 0.0075 0.0075
Brugia malayi CXXC zinc finger family protein 0.0029 0.026 0.0394
Mycobacterium tuberculosis Conserved protein 0.0043 0.0457 0.0958
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0202 0.2607 0.3946
Schistosoma mansoni z-protein (S1r protein) 0.0019 0.0118 0.0127
Loa Loa (eye worm) hypothetical protein 0.0043 0.0457 0.0692
Schistosoma mansoni thyroid hormone receptor 0.0015 0.0075 0.0081
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0043 0.0457 0.0958
Loa Loa (eye worm) flap endonuclease-1 0.0025 0.0208 0.0315
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0015 0.0075 0.0075
Mycobacterium ulcerans glutaminase 0.0319 0.4202 1
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 0.004 0.0413 0.0413
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.0064 0.0733 0.0733
Mycobacterium tuberculosis Probable hydrolase 0.0043 0.0457 0.0958
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0029 0.0267 0.0286
Mycobacterium ulcerans esterase/lipase LipP 0.0043 0.0457 0.0827
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0015 0.0075 0.0114
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.012 0.0181
Leishmania major calcium channel protein, putative,ion transporter, putative 0.0083 0.0995 1
Loa Loa (eye worm) histone methyltransferase 0.001 0.0003 0.0004
Brugia malayi nuclear receptor NHR-88 0.0015 0.0075 0.0114
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0043 0.0457 0.0692
Schistosoma mansoni RAR-like nuclear receptor 0.0015 0.0075 0.0081
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0278 0.364 1
Brugia malayi hypothetical protein 0.0019 0.0118 0.0179
Loa Loa (eye worm) TAR-binding protein 0.0199 0.2571 0.3893
Brugia malayi Intermediate filament tail domain containing protein 0.0028 0.025 0.0378
Loa Loa (eye worm) hypothetical protein 0.0015 0.0075 0.0114
Brugia malayi mbt repeat family protein 0.0048 0.0521 0.0788
Schistosoma mansoni matrix metallopeptidase-7 (M10 family) 0.0205 0.2654 0.2844
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0015 0.0075 0.0114
Schistosoma mansoni axis inhibition protein axin 0.0019 0.0118 0.0127
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0029 0.0267 0.0267
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.014 0.1767 0.1767
Echinococcus multilocularis dna polymerase kappa 0.0019 0.012 0.012
Brugia malayi ecdysteroid receptor 0.0015 0.0075 0.0114
Loa Loa (eye worm) steroid hormone receptor 0.0015 0.0075 0.0114
Mycobacterium ulcerans hypothetical protein 0.0043 0.0457 0.0827
Loa Loa (eye worm) hypothetical protein 0.0015 0.0075 0.0114
Echinococcus multilocularis tar DNA binding protein 0.0199 0.2571 0.2571
Schistosoma mansoni cpg binding protein 0.0029 0.026 0.0279
Entamoeba histolytica ubiquitin carboxyl-terminal hydrolase domain containing protein 0.004 0.0413 0.4793
Loa Loa (eye worm) matrixin family protein 0.0455 0.6048 0.9156
Brugia malayi MH2 domain containing protein 0.0144 0.1825 0.2763
Onchocerca volvulus Huntingtin homolog 0.0124 0.1547 0.2463
Schistosoma mansoni terminal deoxycytidyl transferase 0.0019 0.012 0.0128
Brugia malayi regulator of G-protein signaling rgs-7 0.0019 0.0118 0.0179
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.0064 0.0733 0.7006
Echinococcus multilocularis geminin 0.018 0.231 0.231
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0015 0.0075 0.0081
Brugia malayi Matrixin family protein 0.0205 0.2654 0.4017
Echinococcus multilocularis microtubule associated protein 2 0.0697 0.9329 0.9329
Echinococcus granulosus lamin 0.0028 0.025 0.025
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0015 0.0075 0.0114
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.0019 0.0118 0.0127
Brugia malayi hypothetical protein 0.0118 0.1464 0.2217
Leishmania major flap endonuclease-1 (FEN-1), putative 0.0025 0.0208 0.1011
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0015 0.0075 0.0081
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0019 0.012 0.0004
Mycobacterium tuberculosis Probable peptidoglycan hydrolase 0.025 0.3261 0.8922
Echinococcus multilocularis polycomb protein SCMH1 0.0048 0.0521 0.0521
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0015 0.0075 0.0114
Loa Loa (eye worm) hypothetical protein 0.0013 0.0044 0.0067
Schistosoma mansoni regulator of G protein signaling 0.0019 0.0118 0.0127
Echinococcus multilocularis axis inhibition protein axin 0.0019 0.0118 0.0118
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0199 0.2571 0.3893
Echinococcus multilocularis regulator of G protein signaling 3 0.0019 0.0118 0.0118
Echinococcus granulosus ubiquitin specific protease 41 0.004 0.0413 0.0413
Brugia malayi cytoplasmic intermediate filament protein 0.0015 0.0072 0.0109
Mycobacterium tuberculosis Probable esterase LipL 0.0043 0.0457 0.0958
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.014 0.1767 0.1767
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0043 0.0457 0.0692
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.012 0.1136
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0015 0.0075 0.0114
Echinococcus multilocularis axis inhibition protein axin 0.0019 0.0118 0.0118
Echinococcus granulosus endonuclease exonuclease phosphatase 0.019 0.2444 0.2444
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.012 0.1136
Mycobacterium ulcerans lipase LipD 0.0043 0.0457 0.0827
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0457 0.5503
Loa Loa (eye worm) matrix metalloproteinase 0.0205 0.2654 0.4017
Echinococcus multilocularis dna polymerase eta 0.0019 0.012 0.012
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0015 0.0075 0.0075
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0064 0.0733 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.012 0.1136
Schistosoma mansoni intermediate filament proteins 0.0028 0.025 0.0267
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0226 0.2938 0.4447
Trypanosoma brucei hypothetical protein, conserved 0.0043 0.0457 0.6014
Loa Loa (eye worm) hypothetical protein 0.0124 0.1547 0.2341
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0064 0.0733 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.012 0.1136
Schistosoma mansoni regulator of G protein signaling 0.0019 0.0118 0.0127
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0267 0.0286
Echinococcus granulosus cpg binding protein 0.0031 0.0283 0.0283
Brugia malayi Hemopexin family protein 0.0291 0.3818 0.5781
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.012 0.1136
Entamoeba histolytica Flap nuclease, putative 0.0025 0.0208 0.1467
Toxoplasma gondii histone lysine methyltransferase SET1 0.0056 0.0627 1
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0015 0.0075 0.0114
Mycobacterium tuberculosis Conserved protein 0.0043 0.0457 0.0958
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0015 0.0075 0.0075
Echinococcus granulosus A kinase anchor protein 10 mitochondrial 0.0019 0.0118 0.0118
Loa Loa (eye worm) hypothetical protein 0.0015 0.0075 0.0114
Brugia malayi hypothetical protein 0.0019 0.0118 0.0179
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0014 0.0051 0.0051
Loa Loa (eye worm) hypothetical protein 0.0124 0.1547 0.2341
Schistosoma mansoni tar DNA-binding protein 0.0199 0.2571 0.2756
Echinococcus multilocularis lamin 0.0028 0.025 0.025
Loa Loa (eye worm) RGS-3 protein 0.0019 0.0118 0.0179
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0015 0.0075 0.0075
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0457 0.049
Brugia malayi PXA domain containing protein 0.0019 0.0118 0.0179
Brugia malayi Regulator of G protein signaling domain containing protein 0.0019 0.0118 0.0179
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0015 0.0075 0.0114
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) 0.004 0.0413 0.0443
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.004 0.0413 0.4779
Onchocerca volvulus 0.0229 0.2984 0.487
Schistosoma mansoni cpg binding protein 0.0031 0.0283 0.0303
Echinococcus granulosus dnaJ subfamily B 0.0413 0.5475 0.5475
Loa Loa (eye worm) hypothetical protein 0.0043 0.0457 0.0692
Loa Loa (eye worm) hypothetical protein 0.0205 0.2654 0.4017
Schistosoma mansoni glutaminase 0.0319 0.4202 0.4504
Brugia malayi Matrixin family protein 0.0496 0.6605 1
Echinococcus granulosus histone lysine methyltransferase setb 0.0029 0.0267 0.0267
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0015 0.0075 0.0114
Echinococcus granulosus axis inhibition protein axin 0.0019 0.0118 0.0118
Loa Loa (eye worm) hypothetical protein 0.0028 0.025 0.0378
Loa Loa (eye worm) hypothetical protein 0.0015 0.0075 0.0114
Loa Loa (eye worm) AGC/GRK/GRK protein kinase 0.0019 0.0118 0.0179
Schistosoma mansoni tar DNA-binding protein 0.0199 0.2571 0.2756
Trichomonas vaginalis esterase, putative 0.0043 0.0457 0.083
Onchocerca volvulus 0.0043 0.0457 0.0639
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0015 0.0075 0.0114
Loa Loa (eye worm) hypothetical protein 0.0205 0.2654 0.4017
Echinococcus granulosus dna polymerase kappa 0.0019 0.012 0.012
Brugia malayi regulator of G-protein signaling egl-10 0.0019 0.0118 0.0179
Mycobacterium ulcerans beta-lactamase 0.0043 0.0457 0.0827
Trichomonas vaginalis glutaminase, putative 0.0319 0.4202 1
Loa Loa (eye worm) RNA binding protein 0.0199 0.2571 0.3893
Loa Loa (eye worm) hypothetical protein 0.0015 0.0075 0.0114
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0063 0.0716 0.0768
Trypanosoma brucei flap endonuclease-1 (FEN-1), putative 0.0025 0.0208 0.2416
Echinococcus granulosus Regulator of G protein signaling 20 0.0019 0.0118 0.0118
Plasmodium vivax hypothetical protein, conserved 0.0043 0.0457 1
Onchocerca volvulus 0.0147 0.187 0.3005
Brugia malayi nuclear hormone receptor 0.0015 0.0075 0.0114
Brugia malayi hypothetical protein 0.0124 0.1547 0.2341
Loa Loa (eye worm) hypothetical protein 0.0019 0.0118 0.0179
Brugia malayi hypothetical protein 0.0147 0.187 0.2831
Echinococcus granulosus flap endonuclease 1 0.0025 0.0208 0.0208
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0064 0.0733 1
Entamoeba histolytica deoxycytidyl transferase, putative 0.0019 0.012 0.0028
Echinococcus granulosus regulator of G protein signaling 7 0.0019 0.0118 0.0118
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0015 0.0075 0.0081
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0015 0.0075 0.0114
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0019 0.012 0.0181
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0015 0.0075 0.0114
Echinococcus multilocularis flap endonuclease 1 0.0025 0.0208 0.0208
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0015 0.0075 0.0081
Schistosoma mansoni cpg binding protein 0.0031 0.0283 0.0303
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0043 0.0457 0.0958
Echinococcus multilocularis SAM and MBT domain containing protein 0.0048 0.0521 0.0521
Giardia lamblia Flap structure-specific endonuclease 0.0025 0.0208 0.3021
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0457 0.083
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0015 0.0075 0.0114
Mycobacterium tuberculosis Conserved protein 0.0043 0.0457 0.0958
Plasmodium vivax SET domain protein, putative 0.0029 0.0267 0.2355
Schistosoma mansoni tar DNA-binding protein 0.0199 0.2571 0.2756
Loa Loa (eye worm) hypothetical protein 0.0019 0.0118 0.0179
Onchocerca volvulus 0.0028 0.025 0.0292
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.004 0.0413 0.0722
Loa Loa (eye worm) hypothetical protein 0.0205 0.2654 0.4017
Loa Loa (eye worm) hypothetical protein 0.0043 0.0457 0.0692
Loa Loa (eye worm) G protein signaling regulator EGL-10 0.0019 0.0118 0.0179
Loa Loa (eye worm) hypothetical protein 0.0019 0.0118 0.0179
Echinococcus granulosus lamin dm0 0.0028 0.025 0.025
Brugia malayi Pre-SET motif family protein 0.0202 0.2607 0.3946
Brugia malayi mbt repeat family protein 0.0048 0.0521 0.0788
Echinococcus multilocularis thyroid hormone receptor alpha 0.0015 0.0075 0.0075
Brugia malayi Nuclear hormone receptor-like 1 0.0015 0.0075 0.0114
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0055 0.0611 0.0611
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0048 0.0521 0.0558
Schistosoma mansoni regulator of G protein signaling 0.0019 0.0118 0.0127
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0015 0.0075 0.0114
Schistosoma mansoni steroid hormone receptor ad4bp 0.0015 0.0075 0.0081
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0028 0.0244 0.0244
Brugia malayi Matrixin family protein 0.0205 0.2654 0.4017
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0015 0.0075 0.0075
Loa Loa (eye worm) hypothetical protein 0.0015 0.0075 0.0114
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0015 0.0075 0.0075
Brugia malayi TAR-binding protein 0.0199 0.2571 0.3893
Echinococcus granulosus microtubule associated protein 2 0.0697 0.9329 0.9329
Schistosoma mansoni lamin 0.0028 0.025 0.0267
Onchocerca volvulus 0.0029 0.0267 0.0321
Echinococcus granulosus sodium channel protein 0.0083 0.0995 0.0995
Schistosoma mansoni retinoic acid receptor RXR 0.0015 0.0075 0.0081
Echinococcus granulosus geminin 0.018 0.231 0.231
Brugia malayi Matrixin family protein 0.0205 0.2654 0.4017
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.001 0.0003 0.0003
Brugia malayi Pre-SET motif family protein 0.0029 0.0267 0.0404
Brugia malayi beta-lactamase 0.0043 0.0457 0.0692
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) 0.004 0.0413 0.0443
Trypanosoma cruzi flap endonuclease-1 (FEN-1), putative 0.0025 0.0208 0.1443
Loa Loa (eye worm) glutaminase 0.0319 0.4202 0.6361
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0015 0.0075 0.0075
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.012 0.1136
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.014 0.1767 0.1894
Schistosoma mansoni thyroid hormone receptor 0.0015 0.0075 0.0081
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0015 0.0075 0.0114
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0015 0.0075 0.0075
Onchocerca volvulus 0.0028 0.025 0.0292
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0015 0.0075 0.0081
Schistosoma mansoni hypothetical protein 0.0291 0.3818 0.4093
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0015 0.0075 0.0075
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0015 0.0075 0.0114
Echinococcus multilocularis lamin dm0 0.0028 0.025 0.025
Brugia malayi Probable G protein-coupled receptor kinase F19C6.1, putative 0.0019 0.0118 0.0179
Loa Loa (eye worm) hypothetical protein 0.0013 0.0044 0.0067
Echinococcus multilocularis regulator of G protein signaling 7 0.0019 0.0118 0.0118
Onchocerca volvulus 0.0043 0.0457 0.0639
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0014 0.0051 0.0051
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0029 0.0267 0.14
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.012 0.1136
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0019 0.012 0.0128
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0048 0.0521 0.0746
Schistosoma mansoni hypothetical protein 0.0293 0.3843 0.4119
Loa Loa (eye worm) MBCTL1 0.0055 0.0611 0.0925
Mycobacterium tuberculosis Probable lipase LipE 0.0043 0.0457 0.0958
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0029 0.0267 0.0267
Echinococcus granulosus expressed protein 0.0361 0.4766 0.4766
Onchocerca volvulus 0.0205 0.2654 0.4317
Echinococcus multilocularis beta adrenergic receptor kinase 0.0019 0.0118 0.0118
Loa Loa (eye worm) hypothetical protein 0.0147 0.187 0.2831
Echinococcus granulosus dna polymerase eta 0.0019 0.012 0.012
Echinococcus granulosus regulator of G protein signaling 3 0.0019 0.0118 0.0118
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.014 0.1767 0.1767
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.0064 0.0733 0.0733
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0015 0.0075 0.0075
Echinococcus granulosus FTZ F1 alpha 0.0015 0.0075 0.0075
Brugia malayi Matrixin family protein 0.0205 0.2654 0.4017
Loa Loa (eye worm) intermediate filament protein 0.0028 0.025 0.0378
Schistosoma mansoni hypothetical protein 0.018 0.231 0.2476
Echinococcus multilocularis A kinase anchor protein 10, mitochondrial 0.0019 0.0118 0.0118
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0015 0.0075 0.0114
Loa Loa (eye worm) hypothetical protein 0.0028 0.0243 0.0367
Echinococcus multilocularis regulator of G protein signaling 7 0.0019 0.0118 0.0118
Brugia malayi F/Y-rich N-terminus family protein 0.001 0.0001 0.0002
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.012 0.0181
Onchocerca volvulus Matrilysin homolog 0.0205 0.2654 0.4317
Schistosoma mansoni hypothetical protein 0.0413 0.5475 0.5869
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0015 0.0075 0.0114
Onchocerca volvulus Matrix metalloproteinase homolog 0.0455 0.6048 1
Echinococcus granulosus voltage gated sodium channel Nav1 alpha subunit 0.0083 0.0995 0.0995
Trichomonas vaginalis DNA polymerase eta, putative 0.0019 0.012 0.0004
Onchocerca volvulus 0.0043 0.0457 0.0639
Brugia malayi beta-lactamase family protein 0.0043 0.0457 0.0692
Loa Loa (eye worm) CXXC zinc finger family protein 0.0029 0.026 0.0394
Schistosoma mansoni serine/threonine protein kinase 0.0019 0.0118 0.0127
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 0.004 0.0413 0.0413
Schistosoma mansoni serine/threonine protein kinase 0.0019 0.0118 0.0127
Schistosoma mansoni regulator of G protein signaling 3 rgs3 0.0019 0.0118 0.0127
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative 0.004 0.0413 0.3348
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.012 0.1136
Brugia malayi beta-lactamase family protein 0.0043 0.0457 0.0692
Schistosoma mansoni sex comb on midleg homolog 0.0048 0.0521 0.0558
Echinococcus multilocularis ecdysone induced protein 78C 0.0015 0.0075 0.0075
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.0064 0.0733 0.111
Onchocerca volvulus 0.0029 0.026 0.031
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0457 0.5503
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.0064 0.0733 1
Echinococcus granulosus intermediate filament protein 0.0028 0.025 0.025
Loa Loa (eye worm) hypothetical protein 0.0019 0.0118 0.0179
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0055 0.0611 0.0611
Loa Loa (eye worm) AGC/GRK/BARK protein kinase 0.0019 0.0118 0.0179
Echinococcus multilocularis Regulator of G protein signaling 20 0.0019 0.0118 0.0118
Loa Loa (eye worm) hypothetical protein 0.0015 0.0075 0.0114
Onchocerca volvulus Huntingtin homolog 0.0124 0.1547 0.2463
Loa Loa (eye worm) hypothetical protein 0.0048 0.0521 0.0788
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.014 0.1767 0.2676
Echinococcus granulosus axis inhibition protein axin 0.0019 0.0118 0.0118
Brugia malayi RNA recognition motif domain containing protein 0.0199 0.2571 0.3893
Loa Loa (eye worm) hypothetical protein 0.004 0.0413 0.0625
Schistosoma mansoni tar DNA-binding protein 0.0199 0.2571 0.2756

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.1122 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) = 0.631 um PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))] ChEMBL. No reference
Potency (functional) 5.6234 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) 22.3872 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860] 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.

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