Detailed information for compound 738074

Basic information

Technical information
  • TDR Targets ID: 738074
  • Name: 2-(1,3-dimethyl-2,6-dioxopurin-9-yl)-N-(4-hyd roxyphenyl)acetamide
  • MW: 329.311 | Formula: C15H15N5O4
  • H donors: 2 H acceptors: 5 LogP: 0.22 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: Oc1ccc(cc1)NC(=O)Cn1cnc2c1n(C)c(=O)n(c2=O)C
  • InChi: 1S/C15H15N5O4/c1-18-13-12(14(23)19(2)15(18)24)16-8-20(13)7-11(22)17-9-3-5-10(21)6-4-9/h3-6,8,21H,7H2,1-2H3,(H,17,22)
  • InChiKey: KURCJDGIZULLDT-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 2-(1,3-dimethyl-2,6-dioxo-purin-9-yl)-N-(4-hydroxyphenyl)acetamide
  • 2-(1,3-dimethyl-2,6-dioxo-9-purinyl)-N-(4-hydroxyphenyl)acetamide
  • 2-(2,6-diketo-1,3-dimethyl-purin-9-yl)-N-(4-hydroxyphenyl)acetamide
  • 2-(1,3-dimethyl-2,6-dioxo-purin-9-yl)-N-(4-hydroxyphenyl)ethanamide
  • BAS 07603065
  • AN-465/41992606
  • ZINC00612219

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) MH2 domain-containing protein 0.0475 0.5 0.9226
Loa Loa (eye worm) latrophilin receptor protein 2 0.0016 0.0039 0.0025
Loa Loa (eye worm) fli-1 protein 0.0228 0.2334 0.4282
Schistosoma mansoni survival motor neuron protein 0.0047 0.0377 0.0471
Schistosoma mansoni microtubule-associated protein tau 0.0705 0.7487 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0379 0.0474
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0022 0.0107 0.0501
Schistosoma mansoni zinc finger protein 0.0015 0.0036 0.0014
Loa Loa (eye worm) hypothetical protein 0.0034 0.0236 0.0391
Schistosoma mansoni hypothetical protein 0.0047 0.0377 0.0471
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0016 0.0039 0.0018
Plasmodium vivax importin-beta 2, putative 0.003 0.0193 0.0633
Echinococcus granulosus histone lysine methyltransferase setb 0.0048 0.0392 0.0491
Loa Loa (eye worm) hypothetical protein 0.0147 0.1455 0.2651
Entamoeba histolytica hypothetical protein 0.0035 0.0248 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0379 0.0474
Loa Loa (eye worm) PHD-finger family protein 0.0021 0.0094 0.0127
Loa Loa (eye worm) hypothetical protein 0.0016 0.0039 0.0025
Echinococcus multilocularis dnaJ subfamily B 0.0422 0.4426 0.5898
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0024 0.0131 0.0102
Loa Loa (eye worm) hypothetical protein 0.0048 0.0392 0.0679
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.0379 0.0474
Schistosoma mansoni hypothetical protein 0.0016 0.0039 0.0018
Loa Loa (eye worm) CXXC zinc finger family protein 0.003 0.0189 0.0304
Brugia malayi Pre-SET motif family protein 0.0213 0.2174 0.4012
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0032 0.0219 0.0259
Entamoeba histolytica hypothetical protein 0.0035 0.0248 1
Brugia malayi hypothetical protein 0.023 0.2357 0.435
Trypanosoma cruzi hypothetical protein, conserved 0.0147 0.1455 1
Echinococcus granulosus GTP binding nuclear protein Ran 0.0022 0.0107 0.0109
Loa Loa (eye worm) hypothetical protein 0.0147 0.1455 0.2651
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0147 0.1455 0.5
Brugia malayi MH2 domain containing protein 0.0014 0.0026 0.0047
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.0248 0.0298
Schistosoma mansoni hypothetical protein 0.0035 0.0248 0.0298
Entamoeba histolytica hypothetical protein 0.0035 0.0248 1
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0024 0.0133 0.0144
Schistosoma mansoni smad1 5 8 and 0.0032 0.0219 0.0259
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0047 0.0379 0.0699
Brugia malayi Pre-SET motif family protein 0.0031 0.0206 0.038
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0048 0.0392 0.0491
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0016 0.0039 0.0018
Onchocerca volvulus 0.0031 0.0206 0.0731
Echinococcus multilocularis survival motor neuron protein 1 0.023 0.2357 0.3124
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0047 0.0379 0.0655
Trypanosoma brucei importin beta-1 subunit, putative 0.003 0.0193 0.1103
Schistosoma mansoni hypothetical protein 0.0016 0.0039 0.0018
Loa Loa (eye worm) hypothetical protein 0.005 0.0406 0.0706
Echinococcus granulosus importin subunit beta 1 0.003 0.0193 0.0224
Echinococcus granulosus snurportin 1 0.0319 0.3321 0.4416
Loa Loa (eye worm) D-ets-4 DNA binding domain-containing protein 0.0075 0.0681 0.1216
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0147 0.1455 0.2686
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0017 0.0055 0.004
Brugia malayi mothers against decapentaplegic homolog 3 0.0014 0.0026 0.0047
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0031 0.0206 0.0731
Leishmania major hypothetical protein, conserved 0.0147 0.1455 1
Brugia malayi MH1 domain containing protein 0.0032 0.0219 0.0404
Schistosoma mansoni cpg binding protein 0.003 0.0189 0.0219
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0031 0.0206 0.0242
Entamoeba histolytica hypothetical protein 0.0035 0.0248 1
Echinococcus granulosus microtubule associated protein 2 0.0705 0.7487 1
Onchocerca volvulus 0.0147 0.1455 0.5798
Onchocerca volvulus 0.0147 0.1455 0.5798
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.005 0.0406 0.075
Loa Loa (eye worm) hypothetical protein 0.0064 0.0563 0.0998
Onchocerca volvulus 0.003 0.0189 0.0664
Schistosoma mansoni smad 0.0032 0.0219 0.0259
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.0206 0.0242
Plasmodium falciparum importin beta, putative 0.003 0.0193 1
Brugia malayi TAR-binding protein 0.0513 0.5418 1
Toxoplasma gondii HEAT repeat-containing protein 0.003 0.0193 0.0633
Loa Loa (eye worm) hypothetical protein 0.0147 0.1455 0.2651
Onchocerca volvulus 0.0243 0.2491 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.0379 0.0474
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0036 0.0261 0.0316
Schistosoma mansoni cpg binding protein 0.0033 0.0228 0.0272
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0036 0.0261 0.0316
Brugia malayi beta-lactamase family protein 0.0147 0.1455 0.2686
Loa Loa (eye worm) hypothetical protein 0.0039 0.0288 0.0486
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0123 0.1194 0.1565
Schistosoma mansoni hypothetical protein 0.0123 0.1194 0.1565
Mycobacterium ulcerans beta-lactamase 0.0147 0.1455 0.5
Schistosoma mansoni thyroid hormone receptor 0.0132 0.13 0.1708
Loa Loa (eye worm) nuclear factor I 0.0018 0.0063 0.0069
Loa Loa (eye worm) hypothetical protein 0.0041 0.0314 0.0534
Echinococcus granulosus survival motor neuron protein 1 0.023 0.2357 0.3124
Trypanosoma cruzi importin beta-1 subunit, putative 0.0024 0.0131 0.0672
Schistosoma mansoni smad1 5 8 and 0.0032 0.0219 0.0259
Echinococcus multilocularis tar DNA binding protein 0.0513 0.5418 0.7227
Trichomonas vaginalis penicillin-binding protein, putative 0.0147 0.1455 0.5654
Schistosoma mansoni ets-related 0.0228 0.2334 0.3094
Loa Loa (eye worm) transcription factor SMAD2 0.0475 0.5 0.9226
Schistosoma mansoni tar DNA-binding protein 0.0513 0.5418 0.7227
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0022 0.0107 0.0198
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0016 0.0039 0.0072
Loa Loa (eye worm) hypothetical protein 0.0018 0.0063 0.0069
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0048 0.0392 0.0491
Loa Loa (eye worm) hypothetical protein 0.023 0.2357 0.4323
Entamoeba histolytica hypothetical protein 0.0024 0.0131 0.1723
Schistosoma mansoni Smad4 0.0032 0.0219 0.0259
Echinococcus granulosus smad 0.0032 0.0219 0.0259
Brugia malayi PHD-finger family protein 0.0027 0.0159 0.0294
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0032 0.0219 0.0259
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.0379 0.0474
Loa Loa (eye worm) hypothetical protein 0.0071 0.064 0.114
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0062 0.0539 0.0687
Schistosoma mansoni hypothetical protein 0.0034 0.0236 0.0283
Leishmania major importin beta-1 subunit, putative 0.0024 0.0131 0.0672
Schistosoma mansoni gabp alpha 0.0075 0.0681 0.0879
Schistosoma mansoni methyl-cpg binding protein mbd 0.0017 0.0055 0.004
Brugia malayi RNA binding protein 0.0513 0.5418 1
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0147 0.1455 0.2651
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0022 0.0107 0.0501
Loa Loa (eye worm) hypothetical protein 0.0147 0.1455 0.2651
Echinococcus granulosus beta LACTamase domain containing family member 0.0147 0.1455 0.1916
Echinococcus multilocularis zinc finger protein 0.0021 0.0101 0.0101
Schistosoma mansoni tar DNA-binding protein 0.0513 0.5418 0.7227
Echinococcus multilocularis Smad4 0.0032 0.0219 0.0259
Trypanosoma brucei importin beta-1 subunit, putative 0.003 0.0193 0.1103
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0024 0.0133 0.0144
Brugia malayi beta-lactamase family protein 0.0147 0.1455 0.2686
Brugia malayi Calcitonin receptor-like protein seb-1 0.005 0.0406 0.075
Echinococcus granulosus Smad4 0.0032 0.0219 0.0259
Brugia malayi Latrophilin receptor protein 2 0.0016 0.0039 0.0072
Loa Loa (eye worm) RNA binding protein 0.0513 0.5418 1
Schistosoma mansoni hypothetical protein 0.0319 0.3321 0.4416
Schistosoma mansoni hypothetical protein 0.0016 0.0039 0.0018
Echinococcus multilocularis tumor protein p63 0.0341 0.3554 0.4729
Brugia malayi Smad1 0.0032 0.0219 0.0404
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0319 0.3321 0.6111
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0024 0.0131 0.0102
Loa Loa (eye worm) beta-lactamase 0.0147 0.1455 0.2651
Trichomonas vaginalis importin beta-1, putative 0.0024 0.0131 0.0102
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0031 0.0206 0.0242
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0147 0.1455 0.1916
Echinococcus multilocularis smad 0.0032 0.0219 0.0259
Onchocerca volvulus 0.005 0.0409 0.1554
Brugia malayi Bromodomain containing protein 0.0077 0.0705 0.1302
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0064 0.056 0.0716
Schistosoma mansoni methyl-cpg binding protein mbd 0.0017 0.0055 0.004
Brugia malayi Fli-1 protein 0.0228 0.2334 0.4309
Trichomonas vaginalis D-aminoacylase, putative 0.0147 0.1455 0.5654
Brugia malayi Bromodomain containing protein 0.0039 0.0287 0.053
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0236 0.0436
Echinococcus multilocularis thyroid hormone receptor alpha 0.0132 0.13 0.1708
Mycobacterium ulcerans hypothetical protein 0.0147 0.1455 0.5
Plasmodium vivax SET domain protein, putative 0.0031 0.0206 0.0731
Echinococcus multilocularis GA binding protein alpha chain 0.0075 0.0681 0.0879
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0379 0.0474
Echinococcus granulosus mothers against decapentaplegic 5 0.0032 0.0219 0.0259
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.0248 0.0298
Echinococcus multilocularis cpg binding protein 0.0033 0.0228 0.0272
Brugia malayi MH1 domain containing protein 0.0018 0.0063 0.0116
Loa Loa (eye worm) pigment dispersing factor receptor c 0.005 0.0406 0.0706
Mycobacterium leprae conserved hypothetical protein 0.0147 0.1455 0.5
Onchocerca volvulus 0.0047 0.0377 0.1424
Echinococcus multilocularis importin subunit beta 1 0.003 0.0193 0.0224
Schistosoma mansoni cellular tumor antigen P53 0.005 0.0409 0.0513
Echinococcus granulosus zinc finger protein 0.0021 0.0101 0.0101
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0029 0.0187 0.0216
Echinococcus granulosus cpg binding protein 0.0033 0.0228 0.0272
Brugia malayi Importin beta-1 subunit 0.003 0.0193 0.0356
Leishmania major GTP-binding protein, putative 0.0022 0.0107 0.0501
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0147 0.1455 0.1916
Loa Loa (eye worm) TAR-binding protein 0.0513 0.5418 1
Schistosoma mansoni bromodomain containing protein 0.0066 0.0578 0.074
Trichomonas vaginalis set domain proteins, putative 0.0243 0.2491 1
Brugia malayi MH2 domain containing protein 0.0032 0.0219 0.0404
Brugia malayi MH2 domain containing protein 0.0032 0.0219 0.0404
Loa Loa (eye worm) hypothetical protein 0.0045 0.0353 0.0606
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0513 0.5418 1
Toxoplasma gondii ABC1 family protein 0.0147 0.1455 1
Schistosoma mansoni tar DNA-binding protein 0.0513 0.5418 0.7227
Schistosoma mansoni hypothetical protein 0.0021 0.0094 0.0092
Echinococcus granulosus GA binding protein alpha chain 0.0075 0.0681 0.0879
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0016 0.0039 0.0018
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0062 0.0539 0.0687
Onchocerca volvulus 0.0147 0.1455 0.5798
Plasmodium vivax hypothetical protein, conserved 0.0147 0.1455 1
Schistosoma mansoni hypothetical protein 0.0016 0.0039 0.0018
Brugia malayi RNA, U transporter 1 0.0085 0.0789 0.1456
Loa Loa (eye worm) hypothetical protein 0.0147 0.1455 0.2651
Toxoplasma gondii histone lysine methyltransferase SET1 0.006 0.0513 0.3014
Echinococcus granulosus methyl CpG binding domain protein 2 0.0017 0.0055 0.004
Echinococcus multilocularis beta LACTamase domain containing family member 0.0147 0.1455 0.1916
Loa Loa (eye worm) hypothetical protein 0.0147 0.1455 0.2651
Brugia malayi CXXC zinc finger family protein 0.003 0.0189 0.0349
Brugia malayi RNA recognition motif domain containing protein 0.0513 0.5418 1
Mycobacterium leprae Probable lipase LipE 0.0147 0.1455 0.5
Brugia malayi beta-lactamase 0.0147 0.1455 0.2686
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0213 0.2174 0.3984
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0022 0.0107 0.0151
Mycobacterium ulcerans esterase/lipase LipP 0.0147 0.1455 0.5
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.0248 0.0298
Echinococcus granulosus fetal alzheimer antigen falz 0.0024 0.0133 0.0144
Schistosoma mansoni tar DNA-binding protein 0.0513 0.5418 0.7227
Brugia malayi MH1 domain containing protein 0.0032 0.0219 0.0404
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0123 0.1194 0.1565
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.0377 0.0695
Echinococcus granulosus dnaJ subfamily B 0.0422 0.4426 0.5898
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0048 0.0392 0.0491
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.0379 0.0474
Trichomonas vaginalis D-aminoacylase, putative 0.0147 0.1455 0.5654
Schistosoma mansoni zinc finger protein 0.0021 0.0101 0.0101
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0022 0.0107 0.5
Brugia malayi MH1 domain containing protein 0.0018 0.0063 0.0116
Trichomonas vaginalis esterase, putative 0.0147 0.1455 0.5654
Echinococcus multilocularis GPCR, family 2 0.0016 0.0039 0.0018
Echinococcus multilocularis mothers against decapentaplegic 5 0.0032 0.0219 0.0259
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0016 0.0039 0.0018
Echinococcus multilocularis snurportin 1 0.0319 0.3321 0.4416
Echinococcus granulosus tumor protein p63 0.0341 0.3554 0.4729
Schistosoma mansoni smad1 5 8 and 0.0032 0.0219 0.0259
Brugia malayi Ets-domain containing protein 0.0075 0.0681 0.1257
Schistosoma mansoni thyroid hormone receptor 0.0132 0.13 0.1708
Echinococcus granulosus GPCR family 2 0.0016 0.0039 0.0018
Brugia malayi MH2 domain containing protein 0.0475 0.5 0.923
Echinococcus granulosus TGF beta signal transducer SmadC 0.0032 0.0219 0.0259
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0022 0.0107 0.0501
Echinococcus granulosus tar DNA binding protein 0.0513 0.5418 0.7227
Loa Loa (eye worm) hypothetical protein 0.005 0.0409 0.071
Schistosoma mansoni importin beta-1 0.003 0.0193 0.0224
Brugia malayi hypothetical protein 0.0035 0.0248 0.0457
Trypanosoma cruzi hypothetical protein, conserved 0.0147 0.1455 1
Loa Loa (eye worm) MH1 domain-containing protein 0.0032 0.0219 0.0359
Trichomonas vaginalis penicillin-binding protein, putative 0.0147 0.1455 0.5654
Schistosoma mansoni ran 0.0022 0.0107 0.0109
Schistosoma mansoni cpg binding protein 0.0033 0.0228 0.0272
Schistosoma mansoni hypothetical protein 0.0015 0.0036 0.0014
Loa Loa (eye worm) hypothetical protein 0.003 0.0193 0.031
Loa Loa (eye worm) Smad1 0.0032 0.0219 0.0359
Brugia malayi Ets-domain containing protein 0.0075 0.0681 0.1257
Trichomonas vaginalis D-aminoacylase, putative 0.0147 0.1455 0.5654
Schistosoma mansoni ran 0.0022 0.0107 0.0109
Loa Loa (eye worm) MH2 domain-containing protein 0.0032 0.0219 0.0359
Echinococcus multilocularis microtubule associated protein 2 0.0705 0.7487 1
Loa Loa (eye worm) bromodomain containing protein 0.0018 0.0062 0.0067
Mycobacterium ulcerans lipase LipD 0.0147 0.1455 0.5
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0022 0.0107 0.0109
Schistosoma mansoni tar DNA-binding protein 0.0513 0.5418 0.7227
Schistosoma mansoni hypothetical protein 0.0422 0.4426 0.5898
Trypanosoma brucei hypothetical protein, conserved 0.0147 0.1455 1

Activities

No activities found for this compound.

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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