Detailed information for compound 1265202

Basic information

Technical information
  • TDR Targets ID: 1265202
  • Name: 6-[(2,4-dimethylphenyl)sulfanylmethyl]-N-(2-m ethylphenyl)-1,3,5-triazine-2,4-diamine
  • MW: 351.469 | Formula: C19H21N5S
  • H donors: 2 H acceptors: 3 LogP: 4.64 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: Nc1nc(CSc2ccc(cc2C)C)nc(n1)Nc1ccccc1C
  • InChi: 1S/C19H21N5S/c1-12-8-9-16(14(3)10-12)25-11-17-22-18(20)24-19(23-17)21-15-7-5-4-6-13(15)2/h4-10H,11H2,1-3H3,(H3,20,21,22,23,24)
  • InChiKey: FQJAGTFWEWVROL-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 6-[[(2,4-dimethylphenyl)thio]methyl]-N-(2-methylphenyl)-1,3,5-triazine-2,4-diamine
  • [4-amino-6-[[(2,4-dimethylphenyl)thio]methyl]-s-triazin-2-yl]-(2-methylphenyl)amine
  • MLS000334680
  • SMR000249438
  • T5304802
  • ZINC03455453

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens l(3)mbt-like 1 (Drosophila) Starlite/ChEMBL No references
Influenza A virus Nonstructural protein 1 Starlite/ChEMBL No references
Homo sapiens lamin A/C Starlite/ChEMBL No references
Homo sapiens glucagon-like peptide 1 receptor Starlite/ChEMBL No references
Homo sapiens euchromatic histone-lysine N-methyltransferase 2 Starlite/ChEMBL No references
Homo sapiens geminin, DNA replication inhibitor Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Brugia malayi Pre-SET motif family protein Get druggable targets OG5_131470 All targets in OG5_131470
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Brugia malayi Intermediate filament tail domain containing protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis lamin Get druggable targets OG5_128723 All targets in OG5_128723
Onchocerca volvulus Get druggable targets OG5_131470 All targets in OG5_131470
Echinococcus multilocularis lamin dm0 Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni hypothetical protein Get druggable targets OG5_130415 All targets in OG5_130415
Loa Loa (eye worm) intermediate filament tail domain-containing protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum Lethal(3)malignant brain tumor-like 4 protein, putative Get druggable targets OG5_130415 All targets in OG5_130415
Echinococcus multilocularis cytoplasmic intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni lamin Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus endonuclease exonuclease phosphatase Get druggable targets OG5_130415 All targets in OG5_130415
Trichomonas vaginalis set domain proteins, putative Get druggable targets OG5_131470 All targets in OG5_131470
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum expressed protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum expressed protein Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) pre-SET domain-containing protein family protein Get druggable targets OG5_131470 All targets in OG5_131470
Onchocerca volvulus Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni lamin Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus lamin Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum Intermediate filament protein ifa-1, putative Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Brugia malayi intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus lamin dm0 Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis musashi Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni intermediate filament proteins Get druggable targets OG5_128723 All targets in OG5_128723
Onchocerca volvulus Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum Lethal(3)malignant brain tumor-like 3 protein, putative Get druggable targets OG5_130415 All targets in OG5_130415
Echinococcus granulosus cytoplasmic intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis endonuclease exonuclease phosphatase Get druggable targets OG5_130415 All targets in OG5_130415
Schistosoma japonicum ko:K07611 lamin, putative Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum Lamin-C, putative Get druggable targets OG5_128723 All targets in OG5_128723
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Mycobacterium tuberculosis Hypothetical protein Nonstructural protein 1   230 aa 202 aa 23.8 %
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 %
Loa Loa (eye worm) pigment dispersing factor receptor c glucagon-like peptide 1 receptor 463 aa 388 aa 25.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus granulosus SAM and MBT domain containing protein 0.0058 0.1443 0.1901
Echinococcus granulosus protein jagged 2 0.0085 0.223 0.2969
Loa Loa (eye worm) hypothetical protein 0.0011 0.007 0.0094
Trypanosoma cruzi ABC transporter, putative 0.001 0.0043 0.5
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.1519 0.205
Loa Loa (eye worm) hypothetical protein 0.0085 0.223 0.301
Schistosoma mansoni laminin gamma-3 chain 0.0085 0.223 0.223
Loa Loa (eye worm) hypothetical protein 0.0058 0.1443 0.1948
Entamoeba histolytica P-glycoprotein-2 0.0011 0.007 1
Echinococcus granulosus lamin dm0 0.0033 0.0711 0.0907
Brugia malayi Cadherin domain containing protein 0.0085 0.223 0.301
Loa Loa (eye worm) hypothetical protein 0.0085 0.223 0.301
Schistosoma mansoni septate junction protein 0.0085 0.223 0.223
Schistosoma mansoni hypothetical protein 0.0019 0.0315 0.0315
Loa Loa (eye worm) blistered cuticle protein 3 0.0262 0.7408 1
Loa Loa (eye worm) hypothetical protein 0.0085 0.223 0.301
Loa Loa (eye worm) hypothetical protein 0.0011 0.007 0.0094
Loa Loa (eye worm) animal heme peroxidase 0.0262 0.7408 1
Schistosoma mansoni notch 0.0085 0.223 0.223
Loa Loa (eye worm) hypothetical protein 0.0085 0.223 0.301
Echinococcus multilocularis multidrug resistance protein 1 0.0011 0.007 0.0037
Loa Loa (eye worm) hypothetical protein 0.0262 0.7408 1
Schistosoma mansoni hypothetical protein 0.0019 0.0315 0.0315
Echinococcus granulosus protein jagged 1 0.0085 0.223 0.2969
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0251 0.7109 0.9596
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0011 0.007 0.0037
Loa Loa (eye worm) hypothetical protein 0.0085 0.223 0.301
Loa Loa (eye worm) hypothetical protein 0.0085 0.223 0.301
Loa Loa (eye worm) ATP-binding cassette sub-family B member 2 0.0011 0.007 0.0094
Loa Loa (eye worm) multidrug resistance protein 3 0.0011 0.007 0.0094
Schistosoma mansoni hypothetical protein 0.0205 0.5743 0.5743
Loa Loa (eye worm) hypothetical protein 0.001 0.0063 0.0085
Schistosoma mansoni peroxidasin 0.0262 0.7408 0.7408
Brugia malayi Delta serrate ligand family protein 0.0085 0.223 0.301
Brugia malayi Intermediate filament tail domain containing protein 0.0033 0.0711 0.0959
Onchocerca volvulus 0.0085 0.223 0.2682
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0227 0.6397 0.8627
Entamoeba histolytica P-glycoprotein-5 0.0011 0.007 1
Echinococcus granulosus fibropellin Ia 0.0085 0.223 0.2969
Schistosoma mansoni hypothetical protein 0.0019 0.0315 0.0315
Echinococcus granulosus multidrug resistance protein 1 0.0011 0.007 0.0037
Loa Loa (eye worm) hypothetical protein 0.0262 0.7408 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.1519 0.205
Loa Loa (eye worm) hypothetical protein 0.0262 0.7408 1
Loa Loa (eye worm) hypothetical protein 0.0085 0.223 0.301
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0036 0.0813 0.1045
Onchocerca volvulus 0.0033 0.0711 0.0796
Echinococcus granulosus neurogenic locus notch protein 0.0085 0.223 0.2969
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0066 0.1676 0.2263
Schistosoma mansoni multidrug resistance protein 0.0011 0.007 0.007
Loa Loa (eye worm) hypothetical protein 0.0085 0.223 0.301
Loa Loa (eye worm) MBCTL1 0.0066 0.1676 0.2263
Schistosoma mansoni voltage-gated potassium channel 0.0085 0.2249 0.2249
Echinococcus multilocularis geminin 0.0205 0.5743 0.7739
Echinococcus multilocularis musashi 0.0033 0.0711 0.0907
Loa Loa (eye worm) animal heme peroxidase 0.0262 0.7408 1
Brugia malayi Animal haem peroxidase family protein 0.0262 0.7408 1
Echinococcus multilocularis protein jagged 1 0.0085 0.223 0.2969
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0011 0.007 0.0037
Schistosoma mansoni ATP-binding cassette sub-family g2 (white protein) (abcg2) 0.001 0.0043 0.0043
Echinococcus granulosus potassium voltage gated channel subfamily A 0.0085 0.2249 0.2996
Loa Loa (eye worm) hypothetical protein 0.006 0.1519 0.205
Brugia malayi intermediate filament protein 0.0033 0.0711 0.0959
Schistosoma mansoni hypothetical protein 0.0085 0.223 0.223
Loa Loa (eye worm) hypothetical protein 0.0041 0.0962 0.1298
Onchocerca volvulus 0.0085 0.223 0.2682
Loa Loa (eye worm) hypothetical protein 0.0262 0.7408 1
Brugia malayi ABC transporter family protein 0.0011 0.007 0.0094
Schistosoma mansoni hypothetical protein 0.0085 0.223 0.223
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.001 0.0043 0.5
Brugia malayi Latrophilin receptor protein 2 0.0019 0.0315 0.0426
Toxoplasma gondii ATP-binding cassette transporter ABC.B1 0.0011 0.007 0.0123
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0813 0.0813
Loa Loa (eye worm) hypothetical protein 0.0262 0.7408 1
Schistosoma mansoni notch 0.0085 0.223 0.223
Onchocerca volvulus Peroxidasin homolog 0.0262 0.7408 0.9111
Toxoplasma gondii EGF family domain-containing protein 0.0085 0.223 1
Brugia malayi Muscle positioning protein 4 0.0085 0.223 0.301
Leishmania major ATP-binding cassette protein subfamily B, member 2, putative 0.0011 0.007 1
Loa Loa (eye worm) hypothetical protein 0.0262 0.7408 1
Schistosoma mansoni intermediate filament proteins 0.0033 0.0711 0.0711
Trichomonas vaginalis set domain proteins, putative 0.0286 0.8125 1
Echinococcus multilocularis neurogenic locus protein delta 0.0085 0.223 0.2969
Entamoeba histolytica P-glycoprotein 5, putative 0.0011 0.007 1
Plasmodium falciparum multidrug resistance protein 1 0.0011 0.007 1
Schistosoma mansoni smdr2 0.0011 0.007 0.007
Schistosoma mansoni hypothetical protein 0.0085 0.223 0.223
Echinococcus multilocularis neurogenic locus notch protein 0.0085 0.223 0.2969
Onchocerca volvulus 0.0036 0.0813 0.0922
Onchocerca volvulus Neurogenic locus notch homolog 0.0085 0.223 0.2682
Onchocerca volvulus 0.0058 0.1443 0.1705
Echinococcus multilocularis peroxidasin 0.0262 0.7408 1
Brugia malayi Calcium binding EGF domain containing protein 0.0085 0.223 0.301
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0036 0.0813 0.1045
Chlamydia trachomatis ABC transporter ATP binding protein/permease 0.0011 0.007 0.5
Onchocerca volvulus 0.0262 0.7408 0.9111
Brugia malayi mbt repeat family protein 0.0058 0.1443 0.1948
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0011 0.007 0.0037
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0019 0.0315 0.037
Echinococcus multilocularis neurogenic locus protein delta 0.0085 0.223 0.2969
Echinococcus granulosus slit 2 protein 0.0085 0.223 0.2969
Echinococcus multilocularis fat cadherin tumor suppressor 0.0085 0.223 0.2969
Loa Loa (eye worm) mbt repeat family protein 0.0058 0.1443 0.1948
Entamoeba histolytica P-glycoprotein-2 0.0011 0.007 1
Brugia malayi Calcium binding EGF domain containing protein 0.0085 0.223 0.301
Brugia malayi GCC2 and GCC3 family protein 0.0085 0.223 0.301
Brugia malayi Cadherin domain containing protein 0.0085 0.223 0.301
Loa Loa (eye worm) hypothetical protein 0.0262 0.7408 1
Loa Loa (eye worm) hypothetical protein 0.0085 0.223 0.301
Echinococcus multilocularis neural cadherin 0.0085 0.223 0.2969
Loa Loa (eye worm) hypothetical protein 0.0085 0.223 0.301
Echinococcus granulosus multidrug resistance protein 1 0.0011 0.007 0.0037
Trypanosoma brucei ATP-binding cassette protein, putative 0.001 0.0043 0.5
Onchocerca volvulus 0.0085 0.223 0.2682
Trypanosoma brucei ABC transporter, putative 0.001 0.0043 0.5
Loa Loa (eye worm) hypothetical protein 0.0085 0.223 0.301
Mycobacterium tuberculosis Probable transmembrane multidrug efflux pump 0.0011 0.007 0.5
Schistosoma mansoni hypothetical protein 0.0085 0.223 0.223
Loa Loa (eye worm) latrophilin receptor protein 2 0.0019 0.0315 0.0426
Brugia malayi EGF-like domain containing protein 0.0085 0.223 0.301
Brugia malayi Animal haem peroxidase family protein 0.0262 0.7408 1
Onchocerca volvulus 0.0262 0.7408 0.9111
Onchocerca volvulus Putative cubilin 0.0085 0.223 0.2682
Brugia malayi mbt repeat family protein 0.0058 0.1443 0.1948
Onchocerca volvulus 0.0262 0.7408 0.9111
Echinococcus multilocularis polycomb protein SCMH1 0.0058 0.1443 0.1901
Echinococcus granulosus potassium voltage gated channel protein 0.0085 0.2249 0.2996
Echinococcus multilocularis SAM and MBT domain containing protein 0.0058 0.1443 0.1901
Loa Loa (eye worm) hypothetical protein 0.0085 0.223 0.301
Schistosoma mansoni sex comb on midleg homolog 0.0058 0.1443 0.1443
Schistosoma mansoni sex comb on midleg homolog 0.0058 0.1443 0.1443
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.1519 0.205
Loa Loa (eye worm) hypothetical protein 0.0036 0.0813 0.1097
Echinococcus multilocularis lamin dm0 0.0033 0.0711 0.0907
Echinococcus granulosus neurogenic locus notch protein 4 0.0085 0.223 0.2969
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0036 0.0813 0.0813
Schistosoma mansoni slit 0.0085 0.223 0.223
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0019 0.0315 0.037
Loa Loa (eye worm) animal heme peroxidase 0.0262 0.7408 1
Schistosoma mansoni hypothetical protein 0.0085 0.223 0.223
Brugia malayi Pre-SET motif family protein 0.0036 0.0813 0.1097
Loa Loa (eye worm) hypothetical protein 0.0262 0.7408 1
Onchocerca volvulus Chorion peroxidase homolog 0.0262 0.7408 0.9111
Onchocerca volvulus Peroxidase homolog 0.0262 0.7408 0.9111
Giardia lamblia High cysteine protein 0.0085 0.223 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0813 0.0813
Schistosoma mansoni myelin transcription factor 1 myt1 0.0066 0.1676 0.1676
Loa Loa (eye worm) hypothetical protein 0.0066 0.1676 0.2263
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0019 0.0315 0.0426
Brugia malayi Animal haem peroxidase family protein 0.0262 0.7408 1
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0011 0.007 0.0037
Schistosoma mansoni voltage-gated potassium channel 0.0085 0.2249 0.2249
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0066 0.1676 0.2218
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.001 0.0043 0.5
Loa Loa (eye worm) Notch2 0.0085 0.223 0.301
Onchocerca volvulus Neurogenic locus notch protein homolog 0.0085 0.223 0.2682
Loa Loa (eye worm) hypothetical protein 0.0085 0.223 0.301
Loa Loa (eye worm) hypothetical protein 0.0085 0.223 0.301
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.001 0.0043 0.5
Entamoeba histolytica P-glycoprotein-2, putative 0.0011 0.007 1
Echinococcus multilocularis potassium voltage gated channel protein 0.0085 0.2249 0.2996
Schistosoma mansoni hypothetical protein 0.0019 0.0315 0.0315
Brugia malayi EGF-like domain containing protein 0.0085 0.223 0.301
Schistosoma mansoni notch 0.0085 0.223 0.223
Onchocerca volvulus 0.0085 0.223 0.2682
Loa Loa (eye worm) hypothetical protein 0.0032 0.0693 0.0936
Brugia malayi Calcium binding EGF domain containing protein 0.0085 0.223 0.301
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0058 0.1443 0.1705
Echinococcus multilocularis slit 2 protein 0.0085 0.223 0.2969
Echinococcus granulosus neurogenic locus protein delta 0.0085 0.223 0.2969
Loa Loa (eye worm) hypothetical protein 0.0085 0.2249 0.3036
Onchocerca volvulus 0.0085 0.223 0.2682
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0227 0.6397 0.8627
Loa Loa (eye worm) hypothetical protein 0.0262 0.7408 1
Echinococcus granulosus multidrug resistance protein 1 0.0011 0.007 0.0037
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0011 0.007 0.0037
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0017 0.0269 0.0362
Schistosoma mansoni multidrug resistance protein 0.0011 0.007 0.007
Brugia malayi Pre-SET motif family protein 0.0251 0.7109 0.9596
Loa Loa (eye worm) hypothetical protein 0.0019 0.0315 0.0426
Echinococcus multilocularis protein jagged 1 0.0085 0.223 0.2969
Loa Loa (eye worm) hypothetical protein 0.0085 0.223 0.301
Loa Loa (eye worm) hypothetical protein 0.0085 0.223 0.301
Echinococcus granulosus 5'partial|ATP binding cassette sub family B 0.001 0.0063 0.0027
Echinococcus granulosus histone lysine methyltransferase setb 0.0036 0.0813 0.1045
Schistosoma mansoni cell polarity protein 0.0085 0.223 0.223
Schistosoma mansoni hypothetical protein 0.0041 0.0962 0.0962
Onchocerca volvulus 0.0033 0.0711 0.0796
Echinococcus granulosus protein jagged 1 0.0085 0.223 0.2969
Echinococcus multilocularis potassium voltage gated channel subfamily A 0.0081 0.214 0.2848
Loa Loa (eye worm) hypothetical protein 0.0262 0.7408 1
Loa Loa (eye worm) hypothetical protein 0.0085 0.223 0.301
Loa Loa (eye worm) intermediate filament protein 0.0033 0.0711 0.0959
Brugia malayi cytoplasmic intermediate filament protein 0.0017 0.0269 0.0362
Entamoeba histolytica P-glyco protein 6, putative 0.0011 0.007 1
Schistosoma mansoni Pro-neuregulin-4 membrane-bound isoform (Pro-NRG4) [Contains: Neuregulin-4 (NRG-4)] 0.0085 0.223 0.223
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0011 0.007 0.0037
Brugia malayi Peroxidasin 0.0262 0.7408 1
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0016 0.0218 0.0238
Echinococcus granulosus neurogenic locus notch protein 0.0085 0.223 0.2969
Brugia malayi Animal haem peroxidase family protein 0.0262 0.7408 1
Echinococcus multilocularis neurogenic locus notch protein 0.0085 0.223 0.2969
Loa Loa (eye worm) animal heme peroxidase 0.0262 0.7408 1
Loa Loa (eye worm) hypothetical protein 0.0033 0.0711 0.0959
Brugia malayi Transmembrane cell adhesion receptor mua-3 precursor, putative 0.0085 0.223 0.301
Brugia malayi EGF-like domain containing protein 0.0085 0.223 0.301
Brugia malayi Animal haem peroxidase family protein 0.0262 0.7408 1
Echinococcus multilocularis lamin 0.0033 0.0711 0.0907
Echinococcus granulosus protein jagged 2 0.0085 0.223 0.2969
Echinococcus multilocularis GPCR, family 2 0.0019 0.0315 0.037
Onchocerca volvulus 0.0286 0.8125 1
Loa Loa (eye worm) hypothetical protein 0.0085 0.223 0.301
Loa Loa (eye worm) hypothetical protein 0.0085 0.223 0.301
Loa Loa (eye worm) hypothetical protein 0.0262 0.7408 1
Plasmodium vivax multidrug resistance protein 1, putative 0.0011 0.007 0.0349
Schistosoma mansoni notch 0.0085 0.223 0.223
Schistosoma mansoni lamin 0.0033 0.0711 0.0711
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0813 0.0813
Loa Loa (eye worm) hypothetical protein 0.0085 0.223 0.301
Schistosoma mansoni hypothetical protein 0.0205 0.5743 0.5743
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0011 0.007 0.0037
Brugia malayi Blistered cuticle protein 3 0.0262 0.7408 1
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.0962 0.1298
Echinococcus multilocularis histone acetyltransferase MYST2 0.0066 0.1676 0.2218
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0019 0.0315 0.037
Echinococcus granulosus peroxidasin 0.0262 0.7408 1
Loa Loa (eye worm) hypothetical protein 0.0016 0.0218 0.0294
Brugia malayi Voltage-gated potassium channel, Shaker-family (KCNA, Kv1-like) alpha-subunit 0.0085 0.2249 0.3036
Schistosoma mansoni notch 0.0085 0.223 0.223
Onchocerca volvulus Slit protein homolog 0.0085 0.223 0.2682
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0016 0.0218 0.0238
Echinococcus granulosus geminin 0.0205 0.5743 0.7739
Loa Loa (eye worm) hypothetical protein 0.0015 0.0201 0.0271
Brugia malayi EGF-like domain containing protein 0.0085 0.223 0.301
Loa Loa (eye worm) hypothetical protein 0.0085 0.223 0.301
Echinococcus granulosus notch 0.0085 0.223 0.2969
Loa Loa (eye worm) notch protein 0.0085 0.223 0.301
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0033 0.0711 0.0959
Echinococcus multilocularis neurogenic locus notch protein 4 0.0085 0.223 0.2969
Leishmania major p-glycoprotein 0.0011 0.007 1
Schistosoma mansoni notch 0.0085 0.223 0.223
Schistosoma mansoni hypothetical protein 0.0085 0.223 0.223
Brugia malayi EGF-like domain containing protein 0.0085 0.223 0.301
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0035 0.0774 0.0993
Loa Loa (eye worm) hypothetical protein 0.0015 0.0201 0.0271
Schistosoma mansoni hypothetical protein 0.0085 0.223 0.223
Brugia malayi notch-like transmembrane receptor 0.0085 0.223 0.301
Schistosoma mansoni multidrug resistance protein 0.0011 0.007 0.007
Echinococcus granulosus delta-like protein 1 0.0085 0.223 0.2969
Echinococcus granulosus GPCR family 2 0.0019 0.0315 0.037
Echinococcus granulosus lamin 0.0033 0.0711 0.0907
Schistosoma mansoni lamin 0.0033 0.0711 0.0711
Schistosoma mansoni peroxidasin 0.0262 0.7408 0.7408
Onchocerca volvulus Peroxidase homolog 0.0262 0.7408 0.9111
Echinococcus granulosus histone acetyltransferase MYST2 0.0066 0.1676 0.2218
Loa Loa (eye worm) hypothetical protein 0.0262 0.7408 1
Onchocerca volvulus Dual oxidase homolog 0.0262 0.7408 0.9111
Echinococcus multilocularis notch 0.0085 0.223 0.2969
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0011 0.007 0.0123
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0066 0.1676 0.2218
Echinococcus granulosus neural cadherin 0.0085 0.223 0.2969
Brugia malayi EGF-like domain containing protein 0.0085 0.223 0.301
Echinococcus granulosus polycomb protein SCMH1 0.0058 0.1443 0.1901
Echinococcus multilocularis ATP binding cassette sub family B 0.001 0.0063 0.0027
Onchocerca volvulus Peroxidasin homolog 0.0262 0.7408 0.9111
Trypanosoma cruzi ATP-binding cassette protein, putative 0.001 0.0043 0.5
Loa Loa (eye worm) hypothetical protein 0.0262 0.7408 1
Echinococcus multilocularis protein jagged 2 0.0085 0.223 0.2969
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0019 0.0315 0.037
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0011 0.007 0.0037
Loa Loa (eye worm) hypothetical protein 0.0085 0.223 0.301
Echinococcus multilocularis fibropellin Ia 0.0085 0.223 0.2969
Brugia malayi EGF-like domain containing protein 0.0085 0.223 0.301
Brugia malayi multidrug resistance protein 3 0.0011 0.007 0.0094
Echinococcus granulosus intermediate filament protein 0.0033 0.0711 0.0907
Loa Loa (eye worm) hypothetical protein 0.0262 0.7408 1
Brugia malayi hypothetical protein 0.0262 0.7408 1
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0036 0.0813 0.352
Plasmodium vivax SET domain protein, putative 0.0036 0.0813 1
Echinococcus multilocularis multidrug resistance protein 1 0.0011 0.007 0.0037
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0011 0.007 0.0037
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0058 0.1443 0.1443
Entamoeba histolytica P-glycoprotein-1 0.0011 0.007 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 0.1585 um PUBCHEM_BIOASSAY: qHTS Assay for the Inhibitors of L3MBTL1. (Class of assay: confirmatory) [Related pubchem assays: 485292 (Probe Development Summary for Inhibitors of L3MBTL1)] ChEMBL. No reference
Potency (functional) 0.7079 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference
Potency (functional) = 8.9125 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Influenza NS1 Protein Function. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 10 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 12.5893 um PUBCHEM_BIOASSAY: qHTS Assay for Modulators of Lamin A Splicing. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 18.3564 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) 18.3564 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) 18.526 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) 26.8545 uM PUBCHEM_BIOASSAY: qHTS profiling assay for firefly luciferase inhibitor/activator using purified enzyme and Km concentrations of substrates (counterscreen for miR-21 project). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2288, AID2289, AID2598, AID411] ChEMBL. No reference
Potency (functional) 29.0929 uM PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] ChEMBL. No reference
Potency (functional) 29.0929 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of RanGTP induced Rango (Ran-regulated importin-beta cargo) - Importin beta complex dissociation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID540262] ChEMBL. No reference
Potency (functional) 35.4813 uM PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 100 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] 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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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