Detailed information for compound 1244555

Basic information

Technical information
  • TDR Targets ID: 1244555
  • Name: 2-[(2,5-dichlorophenyl)sulfonyl-methylamino]- N-(pyridin-4-ylmethyl)acetamide
  • MW: 388.269 | Formula: C15H15Cl2N3O3S
  • H donors: 1 H acceptors: 4 LogP: 2.1 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(CN(S(=O)(=O)c1cc(Cl)ccc1Cl)C)NCc1ccncc1
  • InChi: 1S/C15H15Cl2N3O3S/c1-20(10-15(21)19-9-11-4-6-18-7-5-11)24(22,23)14-8-12(16)2-3-13(14)17/h2-8H,9-10H2,1H3,(H,19,21)
  • InChiKey: AUZHXVAWDHTBPS-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-[(2,5-dichlorophenyl)sulfonyl-methyl-amino]-N-(4-pyridylmethyl)acetamide
  • 2-[(2,5-dichlorophenyl)sulfonyl-methylamino]-N-(4-pyridylmethyl)acetamide
  • 2-[(2,5-dichlorophenyl)sulfonyl-methyl-amino]-N-(pyridin-4-ylmethyl)ethanamide
  • STK321083
  • 2-[(2,5-Dichloro-benzenesulfonyl)-methyl-amino]-N-pyridin-4-ylmethyl-acetamide
  • BAS 06175116
  • ZINC00798589

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens geminin, DNA replication inhibitor Starlite/ChEMBL No references
Homo sapiens lysine (K)-specific methyltransferase 2A 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
Schistosoma mansoni mixed-lineage leukemia protein mll Get druggable targets OG5_130642 All targets in OG5_130642
Echinococcus granulosus guanine nucleotide binding protein Gs 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
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 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
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
Neospora caninum Multidomain chromatinic protein with the following architecture: 3x PHD-bromo-3xPHD-SET domain and associated cysteine cluster a Get druggable targets OG5_130642 All targets in OG5_130642
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative Get druggable targets OG5_131088 All targets in OG5_131088
Toxoplasma gondii histone lysine methyltransferase SET1 Get druggable targets OG5_130642 All targets in OG5_130642
Schistosoma japonicum ko:K09188 myeloid/lymphoid or mixed-lineage leukemia protein 3, putative Get druggable targets OG5_130642 All targets in OG5_130642
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
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 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 Hypothetical 65.5 kDa Trp-Asp repeats containing protein F02E8.5 inchromosome X geminin, DNA replication inhibitor 209 aa 176 aa 27.8 %
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
Loa Loa (eye worm) hypothetical protein 0.0054 0.0338 0.0592
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0091 0.016
Trypanosoma brucei DNA polymerase kappa, putative 0.0013 0.005 0.0088
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0023 0.0117 0.0205
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0049 0.0297 0.0297
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0011 0.0036 0.0018
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0011 0.0034 0.0015
Brugia malayi Nuclear hormone receptor-like 1 0.0054 0.0338 0.0592
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.1386 0.9621 1
Loa Loa (eye worm) hypothetical protein 0.0103 0.0676 0.1184
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0103 0.0676 0.1184
Plasmodium vivax flap endonuclease 1, putative 0.0026 0.0138 1
Schistosoma mansoni nuclear hormone receptor 0.0103 0.0676 0.0676
Loa Loa (eye worm) hypothetical protein 0.0049 0.0297 0.0521
Brugia malayi Nuclear hormone receptor E75 0.0049 0.0297 0.0521
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0344 0.0326
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0011 0.0036 0.0018
Echinococcus multilocularis cpg binding protein 0.0037 0.0214 0.0204
Toxoplasma gondii LsmAD domain-containing protein 0.0025 0.0132 0.3164
Schistosoma mansoni ap endonuclease 0.0023 0.0117 0.0117
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0824 0.5706 1
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0394 0.0394
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0103 0.0676 0.0676
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0023 0.0117 0.0205
Brugia malayi hypothetical protein 0.0025 0.0132 0.0231
Brugia malayi conserved hypotetical protein 0.0049 0.0297 0.0521
Schistosoma mansoni cpg binding protein 0.0037 0.0214 0.0214
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0091 0.016
Loa Loa (eye worm) hypothetical protein 0.0025 0.0132 0.0231
Brugia malayi nuclear receptor RXR 0.0049 0.0297 0.0521
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0132 0.0231
Brugia malayi photoreceptor-specific nuclear receptor 0.0103 0.0676 0.1184
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0009 0.0019 0.0019
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0103 0.0676 0.1184
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.0206 0.0206
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0091 0.016
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0103 0.0676 0.1184
Schistosoma mansoni coup transcription factor 0.0103 0.0676 0.0676
Trypanosoma brucei unspecified product 0.0013 0.005 0.0088
Loa Loa (eye worm) hypothetical protein 0.0049 0.0297 0.0521
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0103 0.0676 0.0658
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0344 0.0344
Loa Loa (eye worm) hypothetical protein 0.0049 0.0297 0.0521
Loa Loa (eye worm) flap endonuclease-1 0.0026 0.0138 0.0241
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0394 0.0394
Loa Loa (eye worm) hypothetical protein 0.0103 0.0676 0.1184
Loa Loa (eye worm) RNA binding protein 0.0062 0.0394 0.069
Echinococcus granulosus dna polymerase kappa 0.0019 0.0091 0.0073
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0091 0.016
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0023 0.0117 0.8514
Echinococcus granulosus cpg binding protein 0.0037 0.0214 0.0196
Trichomonas vaginalis ap endonuclease, putative 0.0023 0.0117 0.835
Trypanosoma brucei DNA polymerase eta, putative 0.0044 0.0266 0.0467
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0049 0.0297 0.0521
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0103 0.0676 0.1184
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0049 0.0297 0.2029
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0091 0.016
Brugia malayi nuclear receptor NHR-88 0.0049 0.0297 0.0521
Leishmania major flap endonuclease-1 (FEN-1), putative 0.0026 0.0138 0.0241
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0023 0.0117 0.8514
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0091 0.016
Loa Loa (eye worm) hypothetical protein 0.0054 0.0338 0.0592
Echinococcus granulosus Nuclear hormone receptor HR96 0.0049 0.0297 0.0279
Loa Loa (eye worm) hypothetical protein 0.0103 0.0676 0.1184
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0103 0.0676 0.1184
Echinococcus multilocularis transcription factor Dp 1 0.0477 0.3286 0.3402
Entamoeba histolytica hypothetical protein 0.0035 0.0206 0.0204
Loa Loa (eye worm) hypothetical protein 0.0103 0.0676 0.1184
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0103 0.0676 0.1184
Brugia malayi steroid hormone receptor 0.0103 0.0676 0.1184
Loa Loa (eye worm) nuclear hormone receptor 0.0049 0.0297 0.0521
Schistosoma mansoni DNA polymerase eta 0.0044 0.0266 0.0266
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0049 0.0297 0.029
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0103 0.0676 0.1184
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0103 0.0676 1
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0824 0.5706 1
Loa Loa (eye worm) hypothetical protein 0.0049 0.0297 0.0521
Trypanosoma brucei DNA polymerase kappa, putative 0.0013 0.005 0.0088
Toxoplasma gondii histone lysine methyltransferase SET1 0.0066 0.0417 1
Echinococcus multilocularis ecdysone induced protein 78C 0.0103 0.0676 0.0684
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0019 0.0091 0.0091
Brugia malayi hypothetical protein 0.0016 0.0071 0.0124
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0091 0.016
Echinococcus granulosus dna polymerase eta 0.0044 0.0266 0.0248
Trypanosoma brucei unspecified product 0.0019 0.0091 0.016
Loa Loa (eye worm) histone methyltransferase 0.0011 0.0034 0.0059
Trypanosoma cruzi DNA polymerase eta, putative 0.0031 0.0175 0.0306
Schistosoma mansoni nuclear receptor 0.0049 0.0297 0.0297
Loa Loa (eye worm) hypothetical protein 0.0049 0.0297 0.0521
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0091 0.016
Brugia malayi CXXC zinc finger family protein 0.0035 0.0201 0.0352
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0103 0.0676 0.0684
Entamoeba histolytica hypothetical protein 0.0035 0.0206 0.0204
Loa Loa (eye worm) TAR-binding protein 0.0062 0.0394 0.069
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0103 0.0676 0.0684
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.0344 0.0603
Schistosoma mansoni ap endonuclease 0.0023 0.0117 0.0117
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0103 0.0676 0.0658
Brugia malayi nuclear hormone receptor 0.0103 0.0676 0.1184
Schistosoma mansoni hypothetical protein 0.0011 0.0036 0.0036
Echinococcus multilocularis dna polymerase eta 0.0044 0.0266 0.0258
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0049 0.0297 0.029
Onchocerca volvulus 0.0049 0.0297 0.2029
Onchocerca volvulus 0.0049 0.0297 0.2029
Giardia lamblia DINP protein human, muc B family 0.0019 0.0091 0.6637
Loa Loa (eye worm) hypothetical protein 0.0103 0.0676 0.1184
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0344 0.0344
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0103 0.0676 0.0658
Echinococcus granulosus nuclear receptor nhr 48 0.0049 0.0297 0.0279
Loa Loa (eye worm) hypothetical protein 0.0049 0.0297 0.0521
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0394 0.0394
Mycobacterium ulcerans DNA polymerase IV 0.0019 0.0091 0.7796
Echinococcus granulosus ecdysone induced protein 78C 0.0103 0.0676 0.0658
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.0344 0.0603
Onchocerca volvulus 0.0103 0.0676 1
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0019 0.0091 0.6267
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.0824 0.5706 1
Schistosoma mansoni hypothetical protein 0.0205 0.1385 0.1385
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0103 0.0676 0.1184
Schistosoma mansoni nuclear receptor 0.0049 0.0297 0.0297
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0103 0.0676 0.1184
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0091 0.016
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0103 0.0676 0.0684
Brugia malayi nuclear hormone receptor family member odr-7 0.0049 0.0297 0.0521
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0103 0.0676 0.0676
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0103 0.0676 0.1184
Schistosoma mansoni thyroid hormone receptor 0.0103 0.0676 0.0676
Schistosoma mansoni hypothetical protein 0.0205 0.1385 0.1385
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0103 0.0676 0.0676
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0049 0.0297 0.029
Brugia malayi hypothetical protein 0.0054 0.0338 0.0592
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0091 0.016
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0344 0.0338
Schistosoma mansoni zinc finger protein 0.0049 0.0297 0.0297
Echinococcus granulosus transcription factor Dp 1 0.0477 0.3286 0.3273
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.0206 0.0195
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0091 0.016
Entamoeba histolytica hypothetical protein 0.0035 0.0206 0.0204
Brugia malayi Steroid receptor seven-up type 2 0.0103 0.0676 0.1184
Echinococcus multilocularis thyroid hormone receptor alpha 0.0103 0.0676 0.0684
Echinococcus multilocularis tar DNA binding protein 0.0062 0.0394 0.039
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0023 0.0117 1
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0132 0.0231
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0023 0.0117 1
Trypanosoma cruzi flap endonuclease-1 (FEN-1), putative 0.0026 0.0138 0.0241
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0049 0.0297 0.2029
Brugia malayi nuclear hormone receptor 0.0049 0.0297 0.0521
Brugia malayi Flap endonuclease-1 0.0026 0.0138 0.0241
Loa Loa (eye worm) hypothetical protein 0.0049 0.0297 0.0521
Schistosoma mansoni nuclear hormone receptor 0.0049 0.0297 0.0297
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0091 0.016
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0049 0.0297 0.0297
Trichomonas vaginalis DNA polymerase eta, putative 0.0019 0.0091 0.6267
Echinococcus multilocularis FTZ F1 alpha 0.0103 0.0676 0.0684
Trypanosoma cruzi DNA polymerase eta, putative 0.0044 0.0266 0.0467
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0132 0.9583
Brugia malayi exodeoxyribonuclease III family protein 0.0023 0.0117 0.0205
Schistosoma mansoni thyroid hormone receptor 0.0103 0.0676 0.0676
Brugia malayi hypothetical protein 0.0049 0.0297 0.0521
Plasmodium vivax ataxin-2 like protein, putative 0.0025 0.0132 0.9583
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0023 0.0117 0.0098
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0344 0.0338
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.0824 0.5706 0.5698
Echinococcus granulosus FTZ F1 alpha 0.0103 0.0676 0.0658
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0091 0.016
Echinococcus granulosus flap endonuclease 1 0.0026 0.0138 0.0119
Loa Loa (eye worm) hypothetical protein 0.0103 0.0676 0.1184
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0054 0.0338 0.0319
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0344 0.0326
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0074 0.0472 0.0472
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0023 0.0117 0.5
Trypanosoma brucei unspecified product 0.0013 0.005 0.0088
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0394 0.0394
Brugia malayi ecdysteroid receptor 0.0103 0.0676 0.1184
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0031 0.0175 0.4194
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0023 0.0117 0.0205
Brugia malayi ImpB/MucB/SamB family protein 0.0044 0.0266 0.0467
Leishmania major DNA polymerase eta, putative 0.0044 0.0266 0.0467
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0019 0.0091 0.016
Mycobacterium ulcerans DNA polymerase IV 0.0019 0.0091 0.7796
Echinococcus granulosus thyroid hormone receptor alpha 0.0049 0.0297 0.0279
Loa Loa (eye worm) hypothetical protein 0.0049 0.0297 0.0521
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0103 0.0676 0.1184
Loa Loa (eye worm) hypothetical protein 0.0054 0.0338 0.0592
Loa Loa (eye worm) hypothetical protein 0.0049 0.0297 0.0521
Echinococcus multilocularis dna polymerase kappa 0.0019 0.0091 0.0075
Brugia malayi nuclear hormone receptor family member nhr-6 0.0049 0.0297 0.0521
Loa Loa (eye worm) hypothetical protein 0.0049 0.0297 0.0521
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0344 0.0344
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0103 0.0676 0.0684
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0054 0.0338 0.0592
Giardia lamblia Flap structure-specific endonuclease 0.0026 0.0138 1
Leishmania major DNA polymerase kappa, putative 0.0019 0.0091 0.016
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0011 0.0034 0.0015
Leishmania major hypothetical protein, conserved 0.0025 0.0132 0.0231
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.0824 0.5706 1
Trypanosoma brucei PAB1-binding protein , putative 0.0025 0.0132 0.0231
Schistosoma mansoni nuclear receptor nhr-48 0.0049 0.0297 0.0297
Brugia malayi ecdysone receptor 0.0049 0.0297 0.0521
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0091 0.016
Loa Loa (eye worm) nuclear receptor NHR-67 0.0049 0.0297 0.0521
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0103 0.0676 0.1184
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0103 0.0676 0.0658
Brugia malayi Nuclear hormone receptor-like 1 0.0103 0.0676 0.1184
Brugia malayi hypothetical protein 0.0049 0.0297 0.0521
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0103 0.0676 0.0684
Brugia malayi nuclear receptor NHR-67 0.0049 0.0297 0.0521
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0049 0.0297 0.0279
Schistosoma mansoni terminal deoxycytidyl transferase 0.0019 0.0091 0.0091
Schistosoma mansoni steroid hormone receptor ad4bp 0.0103 0.0676 0.0676
Loa Loa (eye worm) hypothetical protein 0.0054 0.0338 0.0592
Schistosoma mansoni cpg binding protein 0.0035 0.0201 0.0201
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0103 0.0676 0.0684
Entamoeba histolytica Flap nuclease, putative 0.0026 0.0138 0.0082
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0394 0.0394
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0103 0.0676 0.1184
Onchocerca volvulus Protein ultraspiracle homolog 0.0103 0.0676 1
Loa Loa (eye worm) CXXC zinc finger family protein 0.0035 0.0201 0.0352
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0103 0.0676 0.0658
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0054 0.0338 0.0338
Brugia malayi RNA recognition motif domain containing protein 0.0062 0.0394 0.069
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0023 0.0117 0.0102
Echinococcus granulosus geminin 0.0205 0.1385 0.1369
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0062 0.0394 0.069
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0103 0.0676 0.0658
Toxoplasma gondii exonuclease III APE 0.0023 0.0117 0.2811
Trichomonas vaginalis flap endonuclease-1, putative 0.0026 0.0138 1
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0103 0.0676 0.0676
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0023 0.0117 0.0205
Leishmania major DNA polymerase eta, putative 0.0031 0.0175 0.0306
Echinococcus granulosus Nuclear hormone receptor HR96 0.0049 0.0297 0.0279
Toxoplasma gondii flap structure-specific endonuclease 1, putative 0.0026 0.0138 0.3302
Brugia malayi nuclear receptor NHR-88 0.0103 0.0676 0.1184
Loa Loa (eye worm) hypothetical protein 0.0103 0.0676 0.1184
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.0824 0.5706 1
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0023 0.0117 0.8514
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0054 0.0338 0.0332
Schistosoma mansoni hypothetical protein 0.0035 0.0206 0.0206
Echinococcus multilocularis flap endonuclease 1 0.0026 0.0138 0.0124
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0049 0.0297 0.029
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0103 0.0676 0.0676
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0019 0.0091 0.016
Brugia malayi orphan nuclear receptor NR2E1 0.0049 0.0297 0.0521
Schistosoma mansoni RAR-like nuclear receptor 0.0103 0.0676 0.0676
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0091 0.016
Trypanosoma brucei flap endonuclease-1 (FEN-1), putative 0.0026 0.0138 0.0241
Schistosoma mansoni flap endonuclease-1 0.0023 0.012 0.012
Plasmodium falciparum flap endonuclease 1 0.0026 0.0138 1
Echinococcus multilocularis nuclear receptor nhr 48 0.0049 0.0297 0.029
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0054 0.0338 0.0338
Brugia malayi Nuclear hormone receptor E75 0.0049 0.0297 0.0521
Echinococcus multilocularis geminin 0.0205 0.1385 0.1423
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.0824 0.5706 0.5923
Loa Loa (eye worm) hypothetical protein 0.0103 0.0676 0.1184
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0103 0.0676 0.1184
Loa Loa (eye worm) steroid hormone receptor 0.0103 0.0676 0.1184
Schistosoma mansoni cpg binding protein 0.0037 0.0214 0.0214
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0103 0.0676 0.1184
Loa Loa (eye worm) hypothetical protein 0.0049 0.0297 0.0521
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0023 0.0117 0.0046
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0049 0.0297 0.0521
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.0206 0.0187
Brugia malayi tailless protein 0.0049 0.0297 0.0521
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0132 0.9583
Entamoeba histolytica hypothetical protein 0.0035 0.0206 0.0204
Brugia malayi hypothetical protein 0.0054 0.0338 0.0592
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.0824 0.5706 1
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.0824 0.5706 0.5706
Brugia malayi hypothetical protein 0.0035 0.0206 0.0361
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0103 0.0676 0.1184
Brugia malayi nuclear receptor RXR 0.0054 0.0338 0.0592
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0023 0.0117 0.0205
Echinococcus granulosus tar DNA binding protein 0.0062 0.0394 0.0376
Brugia malayi F/Y-rich N-terminus family protein 0.0011 0.0033 0.0057
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0019 0.0091 0.0075
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0091 0.016
Brugia malayi Nuclear hormone receptor-like 1 0.0054 0.0338 0.0592
Brugia malayi TAR-binding protein 0.0062 0.0394 0.069
Trichomonas vaginalis ap endonuclease, putative 0.0023 0.0117 0.835
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0019 0.0091 0.0073
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.0091 0.016
Treponema pallidum exodeoxyribonuclease (exoA) 0.0023 0.0117 0.5
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0049 0.0297 0.0279
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0091 0.016
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0103 0.0676 0.0676
Trypanosoma brucei DNA polymerase kappa, putative 0.0013 0.005 0.0088
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0824 0.5706 1
Onchocerca volvulus Bile acid receptor homolog 0.0103 0.0676 1
Brugia malayi RNA binding protein 0.0062 0.0394 0.069
Schistosoma mansoni retinoic acid receptor RXR 0.144 1 1
Loa Loa (eye worm) hypothetical protein 0.0044 0.0266 0.0467
Loa Loa (eye worm) hypothetical protein 0.0054 0.0338 0.0592
Loa Loa (eye worm) hypothetical protein 0.0049 0.0297 0.0521
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0103 0.0676 0.1184
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0103 0.0676 0.1184
Loa Loa (eye worm) hypothetical protein 0.0049 0.0297 0.0521
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0103 0.0676 0.1184
Loa Loa (eye worm) DR-78 0.0049 0.0297 0.0521
Schistosoma mansoni nuclear hormone receptor 0.0049 0.0297 0.0297
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0103 0.0676 0.1184

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.092 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) 0.1122 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) = 1.122 um PUBCHEM_BIOASSAY: qHTS Fluorescence Polarization Assay for Inhibitors of MLL CXXC domain - DNA interaction. (Class of assay: confirmatory) [Related pubchem assays: 2698 (Summary assay.)] ChEMBL. No reference
Potency (functional) 9.285 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) 11.2202 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

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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