Detailed information for compound 1515540

Basic information

Technical information
  • TDR Targets ID: 1515540
  • Name: N-[(4-carbamimidoylphenyl)methyl]-2-[(2R)-3-o xo-4-(3-phenylpropylamino)morpholin-2-yl]acet amide
  • MW: 423.508 | Formula: C23H29N5O3
  • H donors: 3 H acceptors: 2 LogP: 1.2 Rotable bonds: 11
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(C[C@H]1OCCN(C1=O)NCCCc1ccccc1)NCc1ccc(cc1)C(=N)N
  • InChi: 1S/C23H29N5O3/c24-22(25)19-10-8-18(9-11-19)16-26-21(29)15-20-23(30)28(13-14-31-20)27-12-4-7-17-5-2-1-3-6-17/h1-3,5-6,8-11,20,27H,4,7,12-16H2,(H3,24,25)(H,26,29)/t20-/m1/s1
  • InChiKey: AUJMHLLCWGLLDP-HXUWFJFHSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-[(4-carbamimidoylphenyl)methyl]-2-[(2R)-3-oxo-4-(3-phenylpropylamino)-2-morpholinyl]acetamide
  • N-(4-amidinobenzyl)-2-[(2R)-3-keto-4-(3-phenylpropylamino)morpholin-2-yl]acetamide
  • N-[(4-carbamimidoylphenyl)methyl]-2-[(2R)-3-oxo-4-(3-phenylpropylamino)morpholin-2-yl]ethanamide

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
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.005 0.0132 0.0251
Echinococcus granulosus Nuclear hormone receptor HR96 0.0033 0.0079 0.0079
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0033 0.0079 0.0079
Echinococcus multilocularis ecdysone induced protein 78C 0.007 0.0199 0.0199
Echinococcus granulosus glutamate NMDA receptor subunit 0.0107 0.0318 0.0318
Schistosoma mansoni RAR-like nuclear receptor 0.007 0.0199 0.0169
Treponema pallidum exodeoxyribonuclease (exoA) 0.0018 0.0031 0.5
Loa Loa (eye worm) thymidylate synthase 0.0324 0.1021 0.1021
Onchocerca volvulus 0.0021 0.0041 0.0032
Loa Loa (eye worm) hypothetical protein 0.0033 0.0079 0.0079
Loa Loa (eye worm) hypothetical protein 0.007 0.0199 0.0199
Schistosoma mansoni thyroid hormone receptor 0.007 0.0199 0.0169
Loa Loa (eye worm) hypothetical protein 0.0033 0.0079 0.0079
Trypanosoma cruzi dihydrofolate reductase-thymidylate synthase 0.151 0.4855 1
Trichomonas vaginalis CMGC family protein kinase 0.005 0.0132 0.2299
Onchocerca volvulus 0.0033 0.0079 0.0422
Echinococcus granulosus thymidylate synthase 0.0324 0.1021 0.1021
Brugia malayi Nuclear hormone receptor family member nhr-40 0.007 0.0199 0.0189
Schistosoma mansoni steroid hormone receptor ad4bp 0.007 0.0199 0.0169
Loa Loa (eye worm) hypothetical protein 0.002 0.0038 0.0038
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0259 0.0811 0.0811
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0018 0.0031 0.0031
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0018 0.0031 0.5
Onchocerca volvulus 0.007 0.0199 0.1644
Echinococcus granulosus glutamate receptor ionotrophic AMPA 3 0.0127 0.0384 0.0384
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0259 0.0811 0.0811
Schistosoma mansoni cpg binding protein 0.003 0.0068 0.0036
Loa Loa (eye worm) cytochrome P450 family protein 0.0012 0.0011 0.0011
Echinococcus granulosus Nuclear hormone receptor HR96 0.0033 0.0079 0.0079
Brugia malayi hypothetical protein 0.0033 0.0079 0.0069
Echinococcus granulosus glutamate receptor subunit protein glur 0.004 0.01 0.01
Brugia malayi Guanylyl cyclase protein 23 0.002 0.0038 0.0027
Leishmania major extracellular receptor, putative 0.002 0.0038 0.0056
Brugia malayi ecdysone receptor 0.0033 0.0079 0.0069
Echinococcus multilocularis nmda type glutamate receptor 0.004 0.01 0.01
Echinococcus multilocularis glutamate receptor subunit protein glur 0.004 0.01 0.01
Echinococcus granulosus microtubule associated protein 2 0.0671 0.2143 0.2143
Echinococcus granulosus FTZ F1 alpha 0.007 0.0199 0.0199
Brugia malayi metabotropic glutamate receptor type 2 0.002 0.0038 0.0027
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0033 0.0079 0.0079
Echinococcus multilocularis mitogen activated protein kinase 3 0.005 0.0132 0.0132
Echinococcus multilocularis atrial natriuretic peptide receptor 0.002 0.0038 0.0038
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0033 0.0079 0.0048
Loa Loa (eye worm) cytochrome P450 family protein 0.0012 0.0011 0.0011
Brugia malayi orphan nuclear receptor NR2E1 0.0033 0.0079 0.0069
Echinococcus multilocularis tissue type plasminogen activator 0.0021 0.0041 0.0041
Schistosoma mansoni glutamate receptor kainate 0.0107 0.0318 0.0288
Loa Loa (eye worm) hypothetical protein 0.0033 0.0079 0.0079
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.007 0.0199 0.0199
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.007 0.0199 0.0199
Loa Loa (eye worm) hypothetical protein 0.007 0.0199 0.0199
Brugia malayi Glutamate receptor 2 precursor 0.0107 0.0318 0.0308
Echinococcus multilocularis dnaJ subfamily B 0.0398 0.1259 0.1259
Echinococcus granulosus metabotropic glutamate receptor 2 0.002 0.0038 0.0038
Brugia malayi Receptor family ligand binding region containing protein 0.002 0.0038 0.0027
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.007 0.0199 0.0169
Loa Loa (eye worm) metabotropic GABA-B receptor subtype 2 0.002 0.0038 0.0038
Brugia malayi Nuclear hormone receptor family member nhr-49 0.007 0.0199 0.0189
Loa Loa (eye worm) hypothetical protein 0.0033 0.0079 0.0079
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.007 0.0199 0.1644
Echinococcus multilocularis glutamate (NMDA) receptor subunit 0.0107 0.0318 0.0318
Brugia malayi Nuclear hormone receptor E75 0.0033 0.0079 0.0069
Echinococcus granulosus retinoic acid receptor rxr beta a 0.007 0.0199 0.0199
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.005 0.0132 0.0251
Loa Loa (eye worm) hypothetical protein 0.007 0.0199 0.0199
Echinococcus granulosus thyroid hormone receptor alpha 0.0033 0.0079 0.0079
Brugia malayi Nuclear hormone receptor family member nhr-19 0.007 0.0199 0.0189
Loa Loa (eye worm) steroid hormone receptor 0.007 0.0199 0.0199
Echinococcus granulosus metabotropic glutamate receptor 5 0.002 0.0038 0.0038
Loa Loa (eye worm) TK/ROR protein kinase 0.0021 0.0041 0.0041
Brugia malayi Nuclear hormone receptor family member nhr-14 0.007 0.0199 0.0189
Loa Loa (eye worm) metabotropic glutamate receptor 8 0.002 0.0038 0.0038
Brugia malayi metabotropic GABA-B receptor subtype 2 0.002 0.0038 0.0027
Brugia malayi hypothetical protein 0.0037 0.0092 0.0081
Echinococcus multilocularis metabotropic glutamate receptor 5 0.002 0.0038 0.0038
Echinococcus multilocularis NMDA receptor 0.0172 0.0527 0.0527
Loa Loa (eye worm) DR-78 0.0033 0.0079 0.0079
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0033 0.0079 0.0048
Brugia malayi Nuclear hormone receptor family member nhr-41 0.007 0.0199 0.0189
Schistosoma mansoni cpg binding protein 0.0028 0.0062 0.0031
Loa Loa (eye worm) hypothetical protein 0.0033 0.0079 0.0079
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0259 0.0811 0.0811
Loa Loa (eye worm) glutamate receptor 1 0.0107 0.0318 0.0318
Brugia malayi nuclear hormone receptor 0.0033 0.0079 0.0069
Toxoplasma gondii kringle domain-containing protein 0.0021 0.0041 0.002
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.007 0.0199 0.0199
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0018 0.0031 0.0042
Schistosoma mansoni serine/threonine protein kinase 0.005 0.0132 0.0101
Entamoeba histolytica hypothetical protein 0.002 0.0038 1
Loa Loa (eye worm) hypothetical protein 0.0037 0.0092 0.0092
Brugia malayi thymidylate synthase 0.0324 0.1021 0.1011
Echinococcus granulosus nmda type glutamate receptor 0.002 0.0038 0.0038
Echinococcus granulosus glutamate receptor 2 0.0127 0.0384 0.0384
Schistosoma mansoni thyroid hormone receptor 0.007 0.0199 0.0169
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0018 0.0031 0.0031
Echinococcus granulosus tissue type plasminogen activator 0.0021 0.0041 0.0041
Schistosoma mansoni hypothetical protein 0.004 0.01 0.0069
Echinococcus granulosus glutamate receptor 2 0.0088 0.0256 0.0256
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.007 0.0199 0.0169
Schistosoma mansoni nuclear receptor 0.0033 0.0079 0.0048
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0018 0.0031 0.0042
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0033 0.0079 0.0422
Schistosoma mansoni glutamate receptor NMDA 0.0127 0.0384 0.0354
Echinococcus granulosus dnaJ subfamily B 0.0398 0.1259 0.1259
Schistosoma mansoni nuclear receptor nhr-48 0.0033 0.0079 0.0048
Loa Loa (eye worm) hypothetical protein 0.0037 0.0092 0.0092
Leishmania major dihydrofolate reductase-thymidylate synthase 0.151 0.4855 1
Onchocerca volvulus 0.0324 0.1021 1
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.005 0.0132 0.0251
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0059 0.0164 0.0133
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.007 0.0199 0.0199
Loa Loa (eye worm) hypothetical protein 0.002 0.0038 0.0038
Echinococcus granulosus mitogen activated protein kinase 0.005 0.0132 0.0132
Brugia malayi nuclear receptor NHR-88 0.007 0.0199 0.0189
Loa Loa (eye worm) hypothetical protein 0.0033 0.0079 0.0079
Echinococcus granulosus cpg binding protein 0.003 0.0068 0.0068
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.007 0.0199 0.0169
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0033 0.0079 0.0079
Brugia malayi Kringle domain containing protein 0.0021 0.0041 0.003
Echinococcus granulosus mitogen activated protein kinase 3 0.005 0.0132 0.0132
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.005 0.0132 0.021
Loa Loa (eye worm) glutamate receptor 0.002 0.0038 0.0038
Loa Loa (eye worm) CXXC zinc finger family protein 0.0028 0.0062 0.0062
Loa Loa (eye worm) hypothetical protein 0.007 0.0199 0.0199
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.007 0.0199 0.0199
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.007 0.0199 0.0199
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0018 0.0031 0.0042
Brugia malayi photoreceptor-specific nuclear receptor 0.007 0.0199 0.0189
Brugia malayi ecdysteroid receptor 0.007 0.0199 0.0189
Schistosoma mansoni cpg binding protein 0.003 0.0068 0.0036
Schistosoma mansoni glutamate receptor AMPA 0.0107 0.0318 0.0288
Brugia malayi hypothetical protein 0.0154 0.0471 0.0461
Echinococcus multilocularis cpg binding protein 0.003 0.0068 0.0068
Loa Loa (eye worm) CYP4Cod1 0.0012 0.0011 0.0011
Brugia malayi Nuclear hormone receptor-like 1 0.007 0.0199 0.0189
Loa Loa (eye worm) nuclear hormone receptor 0.0033 0.0079 0.0079
Echinococcus multilocularis glutamate receptor 2 0.0127 0.0384 0.0384
Echinococcus granulosus nmda type glutamate receptor 0.004 0.01 0.01
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0033 0.0079 0.0079
Loa Loa (eye worm) RGC/RGC protein kinase 0.002 0.0038 0.0038
Trypanosoma brucei protein kinase, putative 0.005 0.0132 0.0251
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0033 0.0079 0.0079
Loa Loa (eye worm) hypothetical protein 0.007 0.0199 0.0199
Mycobacterium ulcerans thymidylate synthase 0.0324 0.1021 0.1011
Plasmodium vivax cysteine repeat modular protein 1, putative 0.0021 0.0041 0.002
Brugia malayi MAP kinase sur-1 0.005 0.0132 0.0122
Echinococcus granulosus atrial natriuretic peptide receptor 0.002 0.0038 0.0038
Loa Loa (eye worm) hypothetical protein 0.007 0.0199 0.0199
Brugia malayi hypothetical protein 0.0033 0.0079 0.0069
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0037 0.0092 0.0092
Echinococcus multilocularis microtubule associated protein 2 0.0671 0.2143 0.2143
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0259 0.0811 0.0811
Echinococcus multilocularis glutamate receptor 2 0.0088 0.0256 0.0256
Loa Loa (eye worm) RGC/RGC protein kinase 0.002 0.0038 0.0038
Loa Loa (eye worm) hypothetical protein 0.002 0.0038 0.0038
Brugia malayi hypothetical protein 0.0037 0.0092 0.0081
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.005 0.0132 0.0251
Schistosoma mansoni ATP-binding cassette transporter 0.0107 0.0318 0.0288
Brugia malayi nuclear hormone receptor family member nhr-6 0.0033 0.0079 0.0069
Echinococcus granulosus Ribosomal protein S1 RNA binding domain 0.004 0.01 0.01
Plasmodium falciparum cysteine repeat modular protein 1 0.0021 0.0041 0.002
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.007 0.0199 0.0199
Schistosoma mansoni microtubule-associated protein tau 0.0671 0.2143 0.2118
Schistosoma mansoni Tr4/Tr2 (homologue) 0.007 0.0199 0.0169
Schistosoma mansoni nuclear hormone receptor 0.0033 0.0079 0.0048
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0033 0.0079 0.0422
Schistosoma mansoni coup transcription factor 0.007 0.0199 0.0169
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0259 0.0811 0.0811
Echinococcus granulosus receptor type guanylyl cyclase 0.002 0.0038 0.0038
Loa Loa (eye worm) hypothetical protein 0.0037 0.0092 0.0092
Brugia malayi nuclear receptor RXR 0.0033 0.0079 0.0069
Brugia malayi Nuclear hormone receptor family member nhr-31 0.007 0.0199 0.0189
Schistosoma mansoni glutamate receptor NMDA 0.0107 0.0318 0.0288
Schistosoma mansoni metabotropic glutamate receptor 0.002 0.0038 0.0007
Brugia malayi Glutamate receptor 1 precursor 0.0107 0.0318 0.0308
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0033 0.0079 0.0069
Loa Loa (eye worm) glutamate receptor 2 0.0107 0.0318 0.0318
Schistosoma mansoni metabotropic glutamate receptor 0.002 0.0038 0.0007
Echinococcus granulosus glutamate receptor ionotropic kainate 3 0.0172 0.0527 0.0527
Brugia malayi steroid hormone receptor 0.007 0.0199 0.0189
Schistosoma mansoni tyrosine kinase 0.002 0.0038 0.0007
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.007 0.0199 0.0199
Schistosoma mansoni glutamate receptor AMPA 0.0107 0.0318 0.0288
Loa Loa (eye worm) hypothetical protein 0.002 0.0038 0.0038
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.007 0.0199 0.0199
Echinococcus granulosus nuclear receptor 2DBD gamma 0.007 0.0199 0.0199
Echinococcus multilocularis metabotropic glutamate receptor 2 0.002 0.0038 0.0038
Loa Loa (eye worm) hypothetical protein 0.007 0.0199 0.0199
Brugia malayi CXXC zinc finger family protein 0.0028 0.0062 0.0052
Plasmodium vivax bifunctional dihydrofolate reductase-thymidylate synthase, putative 0.151 0.4855 1
Brugia malayi tailless protein 0.0033 0.0079 0.0069
Loa Loa (eye worm) hypothetical protein 0.0033 0.0079 0.0079
Mycobacterium tuberculosis Hypothetical protein 0.0154 0.0471 0.0441
Echinococcus granulosus ecdysone induced protein 78C 0.007 0.0199 0.0199
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0018 0.0031 0.0042
Schistosoma mansoni hypothetical protein 0.0021 0.0041 0.001
Echinococcus multilocularis glutamate receptor, ionotrophic, AMPA 3 0.0127 0.0384 0.0384
Echinococcus multilocularis mitogen activated protein kinase 0.005 0.0132 0.0132
Echinococcus multilocularis tyrosine kinase 0.002 0.0038 0.0038
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0033 0.0079 0.0079
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.007 0.0199 0.0199
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.007 0.0199 0.0199
Echinococcus multilocularis Ribosomal protein S1, RNA binding domain 0.004 0.01 0.01
Onchocerca volvulus Protein ultraspiracle homolog 0.007 0.0199 0.1644
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.005 0.0132 0.0251
Loa Loa (eye worm) hypothetical protein 0.0033 0.0079 0.0079
Loa Loa (eye worm) hypothetical protein 0.0037 0.0092 0.0092
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.007 0.0199 0.0199
Trypanosoma cruzi extracellular receptor, putative 0.002 0.0038 0.0056
Brugia malayi Nuclear hormone receptor-like 1 0.0037 0.0092 0.0081
Loa Loa (eye worm) receptor family ligand binding region containing protein 0.002 0.0038 0.0038
Loa Loa (eye worm) hypothetical protein 0.002 0.0038 0.0038
Brugia malayi Nuclear hormone receptor family member nhr-3 0.007 0.0199 0.0189
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.007 0.0199 0.0199
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.007 0.0199 0.0199
Brugia malayi Metabotropic glutamate receptor precursor. 0.002 0.0038 0.0027
Trichomonas vaginalis CMGC family protein kinase 0.005 0.0132 0.2299
Loa Loa (eye worm) hypothetical protein 0.0037 0.0092 0.0092
Schistosoma mansoni hypothetical protein 0.0398 0.1259 0.1231
Schistosoma mansoni glutamate receptor kainate 0.0239 0.0745 0.0716
Schistosoma mansoni retinoic acid receptor RXR 0.007 0.0199 0.0169
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0033 0.0079 0.0079
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0037 0.0092 0.0061
Echinococcus granulosus nuclear receptor nhr 48 0.0033 0.0079 0.0079
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0037 0.0092 0.0061
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0259 0.0811 0.0811
Loa Loa (eye worm) hypothetical protein 0.0033 0.0079 0.0079
Echinococcus multilocularis glutamate receptor 2 0.0107 0.0318 0.0318
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.005 0.0132 0.0251
Brugia malayi Nuclear hormone receptor E75 0.0033 0.0079 0.0069
Echinococcus multilocularis thyroid hormone receptor alpha 0.007 0.0199 0.0199
Toxoplasma gondii bifunctional dihydrofolate reductase-thymidylate synthase 0.151 0.4855 1
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0033 0.0079 0.0079
Schistosoma mansoni nuclear hormone receptor 0.0033 0.0079 0.0048
Echinococcus multilocularis thymidylate synthase 0.0324 0.1021 0.1021
Schistosoma mansoni nuclear receptor 0.0033 0.0079 0.0048
Loa Loa (eye worm) hypothetical protein 0.0033 0.0079 0.0079
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0037 0.0092 0.0092
Loa Loa (eye worm) hypothetical protein 0.002 0.0038 0.0038
Schistosoma mansoni zinc finger protein 0.0033 0.0079 0.0048
Trichomonas vaginalis CMGC family protein kinase 0.005 0.0132 0.2299
Brugia malayi nuclear receptor RXR 0.0037 0.0092 0.0081
Trypanosoma brucei dihydrofolate reductase-thymidylate synthase 0.151 0.4855 1
Brugia malayi Nuclear hormone receptor-like 1 0.0037 0.0092 0.0081
Loa Loa (eye worm) hypothetical protein 0.0033 0.0079 0.0079
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.007 0.0199 0.0169
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.007 0.0199 0.0199
Brugia malayi hypothetical protein 0.002 0.0038 0.0027
Echinococcus granulosus nuclear receptor 2DBD gamma 0.007 0.0199 0.0199
Onchocerca volvulus 0.0028 0.0062 0.0251
Schistosoma mansoni nuclear hormone receptor 0.007 0.0199 0.0169
Brugia malayi conserved hypotetical protein 0.0033 0.0079 0.0069
Brugia malayi Nuclear hormone receptor family member nhr-1 0.007 0.0199 0.0189
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 3 0.0172 0.0527 0.0527
Trypanosoma cruzi dihydrofolate reductase-thymidylate synthase, putative 0.0154 0.0471 0.095
Brugia malayi Nuclear hormone receptor family member nhr-25 0.007 0.0199 0.0189
Toxoplasma gondii histone lysine methyltransferase SET1 0.0053 0.0143 0.0232
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0018 0.0031 0.0031
Echinococcus granulosus glutamate receptor ionotropic kainate 0.0172 0.0527 0.0527
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.007 0.0199 0.0199
Loa Loa (eye worm) RGC/RGC protein kinase 0.002 0.0038 0.0038
Loa Loa (eye worm) hypothetical protein 0.007 0.0199 0.0199
Onchocerca volvulus Bile acid receptor homolog 0.007 0.0199 0.1644
Echinococcus granulosus tyrosine kinase 0.002 0.0038 0.0038
Brugia malayi Steroid receptor seven-up type 2 0.007 0.0199 0.0189
Brugia malayi exodeoxyribonuclease III family protein 0.0018 0.0031 0.002
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0037 0.0092 0.0092
Schistosoma mansoni protein kinase 0.002 0.0038 0.0007
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.007 0.0199 0.0189
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.007 0.0199 0.0199
Echinococcus multilocularis FTZ F1 alpha 0.007 0.0199 0.0199
Loa Loa (eye worm) hypothetical protein 0.002 0.0038 0.0038
Trichomonas vaginalis CMGC family protein kinase 0.005 0.0132 0.2299
Brugia malayi nuclear receptor NHR-88 0.0033 0.0079 0.0069
Schistosoma mansoni glutamate receptor kainate 0.0239 0.0745 0.0716
Echinococcus multilocularis nmda type glutamate receptor 0.002 0.0038 0.0038
Loa Loa (eye worm) hypothetical protein 0.0033 0.0079 0.0079
Loa Loa (eye worm) hypothetical protein 0.002 0.0038 0.0038
Loa Loa (eye worm) nuclear receptor NHR-67 0.0033 0.0079 0.0079
Brugia malayi nuclear receptor NHR-67 0.0033 0.0079 0.0069
Trichomonas vaginalis conserved hypothetical protein 0.0154 0.0471 1
Brugia malayi nuclear hormone receptor 0.007 0.0199 0.0189
Leishmania major hypothetical protein, conserved 0.0021 0.0041 0.0062
Schistosoma mansoni tyrosine kinase 0.002 0.0038 0.0007
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.005 0.0132 0.0251
Giardia lamblia Kinase, CMGC MAPK 0.005 0.0132 1
Loa Loa (eye worm) hypothetical protein 0.002 0.0038 0.0038
Echinococcus multilocularis nuclear receptor nhr 48 0.0033 0.0079 0.0079
Brugia malayi Nuclear hormone receptor family member nhr-25 0.007 0.0199 0.0189
Trypanosoma cruzi hypothetical protein, conserved 0.0021 0.0041 0.0062
Schistosoma mansoni bifunctional dihydrofolate reductase-thymidylate synthase 0.0324 0.1021 0.0993
Brugia malayi nuclear hormone receptor family member odr-7 0.0033 0.0079 0.0069
Brugia malayi Nuclear hormone receptor family member nhr-19 0.007 0.0199 0.0189
Echinococcus multilocularis receptor type guanylyl cyclase 0.002 0.0038 0.0038
Plasmodium falciparum bifunctional dihydrofolate reductase-thymidylate synthase 0.151 0.4855 1
Brugia malayi Protein kinase domain containing protein 0.0021 0.0041 0.003
Loa Loa (eye worm) hypothetical protein 0.0033 0.0079 0.0079
Mycobacterium tuberculosis Probable thymidylate synthase ThyA (ts) (TSASE) 0.0324 0.1021 0.0993
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0018 0.0031 0.002
Echinococcus multilocularis glutamate receptor ionotropic kainate 0.0172 0.0527 0.0527
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.005 0.0132 0.0132
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.007 0.0199 0.0189
Schistosoma mansoni retinoid-x-receptor (RXR) 0.007 0.0199 0.0169
Brugia malayi Receptor family ligand binding region containing protein 0.002 0.0038 0.0027
Onchocerca volvulus 0.0033 0.0079 0.0422
Loa Loa (eye worm) hypothetical protein 0.0021 0.0041 0.0041

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 45.4 uM Inhibitory activity against human thrombin ChEMBL. 12954052

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

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.