Detailed information for compound 1850801

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 427.477 | Formula: C20H21N5O4S
  • H donors: 1 H acceptors: 3 LogP: 2.61 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1[nH]n(c(=O)c1N=Nc1cccc(c1)S(=O)(=O)N1CCOCC1)c1ccccc1
  • InChi: 1S/C20H21N5O4S/c1-15-19(20(26)25(23-15)17-7-3-2-4-8-17)22-21-16-6-5-9-18(14-16)30(27,28)24-10-12-29-13-11-24/h2-9,14,23H,10-13H2,1H3
  • InChiKey: MPXCHLFLMXPWPW-UHFFFAOYSA-N  

Network

Hover on a compound node to display the structore

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens huntingtin Starlite/ChEMBL No references
Homo sapiens lysine (K)-specific methyltransferase 2A Starlite/ChEMBL No references
Homo sapiens microtubule-associated protein tau Starlite/ChEMBL No references
Giardia intestinalis Putative fructose-1,6-bisphosphate aldolase Starlite/ChEMBL No references
Homo sapiens polymerase (DNA directed) iota Starlite/ChEMBL No references
Homo sapiens multiple endocrine neoplasia I No references
Mus musculus RAR-related orphan receptor gamma Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Echinococcus granulosus dnaJ subfamily B Get druggable targets OG5_133913 All targets in OG5_133913
Echinococcus multilocularis dnaJ subfamily B Get druggable targets OG5_133913 All targets in OG5_133913
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Echinococcus multilocularis microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
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 hypothetical protein Get druggable targets OG5_133913 All targets in OG5_133913
Brugia malayi hypothetical protein Get druggable targets OG5_132837 All targets in OG5_132837
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_132837 All targets in OG5_132837
Giardia lamblia Fructose-bisphosphate aldolase Get druggable targets OG5_129214 All targets in OG5_129214
Schistosoma mansoni microtubule-associated protein tau Get druggable targets OG5_133504 All targets in OG5_133504
Onchocerca volvulus Huntingtin homolog Get druggable targets OG5_132837 All targets in OG5_132837
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Schistosoma mansoni mixed-lineage leukemia protein mll Get druggable targets OG5_130642 All targets in OG5_130642
Schistosoma japonicum ko:K04380 microtubule-associated protein tau, putative Get druggable targets OG5_133504 All targets in OG5_133504
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
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
Toxoplasma gondii histone lysine methyltransferase SET1 Get druggable targets OG5_130642 All targets in OG5_130642
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_132837 All targets in OG5_132837
Treponema pallidum fructose-bisphosphate aldolase Get druggable targets OG5_129214 All targets in OG5_129214
Onchocerca volvulus Huntingtin homolog Get druggable targets OG5_132837 All targets in OG5_132837
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Schistosoma japonicum Menin, putative Get druggable targets OG5_133913 All targets in OG5_133913
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Echinococcus granulosus microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504

By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba Putative fructose-1,6-bisphosphate aldolase   323 aa 361 aa 25.8 %
Mycobacterium ulcerans fructose-bisphosphate aldolase Putative fructose-1,6-bisphosphate aldolase   323 aa 361 aa 26.9 %
Candida albicans fructose-bisphosphate aldolase Putative fructose-1,6-bisphosphate aldolase   323 aa 358 aa 22.6 %
Candida albicans fructose-bisphosphate aldolase Putative fructose-1,6-bisphosphate aldolase   323 aa 358 aa 22.6 %
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba Putative fructose-1,6-bisphosphate aldolase   323 aa 361 aa 25.5 %

Obtained from network model

Ranking Plot


Putative Targets List


Species Potential target Raw Global Species
Brugia malayi Steroid receptor seven-up type 2 0.0012 0.0014 0.0029
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0044 0.0853
Mycobacterium ulcerans aminopeptidase N PepN 0.0196 0.0513 1
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0196 0.0513 0.0509
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0012 0.0014 0.001
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1 0.0196 0.0513 1
Giardia lamblia Fructose-bisphosphate aldolase 0.0353 0.094 1
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0012 0.0014 0.0029
Schistosoma mansoni coup transcription factor 0.0012 0.0014 0.0014
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.094 1
Echinococcus multilocularis thyroid hormone receptor alpha 0.0012 0.0014 0.001
Trypanosoma cruzi aminopeptidase, putative 0.0196 0.0513 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0044 0.0853
Echinococcus multilocularis ecdysone induced protein 78C 0.0012 0.0014 0.001
Brugia malayi nuclear hormone receptor 0.0012 0.0014 0.0029
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0012 0.0014 0.0014
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0044 0.0853
Loa Loa (eye worm) aminopeptidase N 0.0196 0.0513 0.0513
Loa Loa (eye worm) hypothetical protein 0.0012 0.0014 0.0014
Loa Loa (eye worm) TATA binding protein associated factor 0.0196 0.0513 0.0513
Schistosoma mansoni steroid hormone receptor ad4bp 0.0012 0.0014 0.0014
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0011 0.001 0.0006
Brugia malayi Peptidase family M1 containing protein 0.0196 0.0513 0.1118
Loa Loa (eye worm) peptidase family M1 containing protein 0.0196 0.0513 0.0513
Trypanosoma brucei unspecified product 0.0023 0.0044 0.0853
Trypanosoma brucei aminopeptidase, putative 0.0196 0.0513 1
Echinococcus granulosus geminin 0.0165 0.0429 0.0426
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0196 0.0513 0.0509
Echinococcus multilocularis dnaJ subfamily B 0.0494 0.1324 0.1321
Mycobacterium ulcerans DNA polymerase IV 0.0023 0.0044 0.0853
Trypanosoma brucei DNA polymerase kappa, putative 0.0016 0.0024 0.0469
Echinococcus granulosus cpg binding protein 0.0037 0.008 0.0076
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.094 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0012 0.0014 0.0029
Brugia malayi hypothetical protein 0.0196 0.0513 0.1118
Leishmania major DNA polymerase eta, putative 0.0023 0.0044 0.0853
Trypanosoma brucei metallo-peptidase, Clan MA(E) Family M1 0.0196 0.0513 1
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0012 0.0014 0.0014
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0012 0.0014 0.0014
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0012 0.0014 0.001
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0353 0.094 1
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0196 0.0513 0.0509
Brugia malayi ecdysteroid receptor 0.0012 0.0014 0.0029
Trypanosoma brucei Aminopeptidase M1, putative 0.0196 0.0513 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.094 1
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0011 0.001 0.0006
Brugia malayi Peptidase family M1 containing protein 0.0196 0.0513 0.1118
Trichomonas vaginalis DNA polymerase eta, putative 0.0023 0.0044 0.0448
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0012 0.0014 0.0029
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0172 0.0449 0.8764
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0012 0.0014 0.001
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0196 0.0513 0.0509
Echinococcus multilocularis Peptidase M1, membrane alanine aminopeptidase, N terminal 0.0196 0.0513 0.0509
Schistosoma mansoni RAR-like nuclear receptor 0.0012 0.0014 0.0014
Giardia lamblia DINP protein human, muc B family 0.0023 0.0044 0.0465
Brugia malayi ImpB/MucB/SamB family protein 0.0023 0.0044 0.0095
Plasmodium vivax M1-family alanyl aminopeptidase, putative 0.0196 0.0513 1
Brugia malayi Nuclear hormone receptor-like 1 0.0012 0.0014 0.0029
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0196 0.0513 0.0509
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0196 0.0513 0.0509
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0196 0.0513 0.0509
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0012 0.0014 0.001
Echinococcus granulosus dna polymerase kappa 0.0023 0.0044 0.004
Onchocerca volvulus Huntingtin homolog 0.0148 0.0383 0.7397
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0012 0.0014 0.0029
Loa Loa (eye worm) hypothetical protein 0.0012 0.0014 0.0014
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.094 1
Trypanosoma brucei DNA polymerase eta, putative 0.0023 0.0044 0.0853
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0012 0.0014 0.0029
Schistosoma mansoni aminopeptidase PILS (M01 family) 0.0196 0.0513 0.0513
Trypanosoma cruzi Aminopeptidase M1, putative 0.0196 0.0513 1
Plasmodium vivax M1-family alanyl aminopeptidase, putative 0.0196 0.0513 1
Loa Loa (eye worm) hypothetical protein 0.0012 0.0014 0.0014
Schistosoma mansoni Tata binding protein associated factor (M01 family) 0.0196 0.0513 0.0513
Echinococcus multilocularis FTZ F1 alpha 0.0012 0.0014 0.001
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0012 0.0014 0.0029
Mycobacterium ulcerans DNA polymerase IV 0.0023 0.0044 0.0853
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.0044 0.0853
Schistosoma mansoni cpg binding protein 0.0037 0.008 0.008
Trypanosoma cruzi metallo-peptidase, clan MA(E), family M1, putative 0.0196 0.0513 1
Brugia malayi F/Y-rich N-terminus family protein 0.0011 0.0009 0.002
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.0044 0.0853
Echinococcus granulosus aminopeptidase N 0.0196 0.0513 0.0509
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0044 0.0853
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0012 0.0014 0.0014
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0172 0.0449 1
Loa Loa (eye worm) CXXC zinc finger family protein 0.0035 0.0075 0.0075
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0012 0.0014 0.001
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0012 0.0014 0.0029
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0012 0.0014 0.0014
Trypanosoma brucei DNA polymerase kappa, putative 0.0016 0.0024 0.0469
Mycobacterium ulcerans aminopeptidase N PepN 0.0196 0.0513 1
Leishmania major aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1 0.0196 0.0513 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0044 0.0853
Schistosoma mansoni DNA polymerase eta 0.0023 0.0044 0.0044
Trypanosoma cruzi puromycin-sensitive aminopeptidase-like protein, putative 0.0196 0.0513 1
Echinococcus granulosus microtubule associated protein 2 0.0833 0.2247 0.2244
Loa Loa (eye worm) hypothetical protein 0.0023 0.0044 0.0044
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0009 0.0004 0.0004
Brugia malayi photoreceptor-specific nuclear receptor 0.0012 0.0014 0.0029
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0012 0.0014 0.0014
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0012 0.0014 0.0029
Trypanosoma cruzi metallo-peptidase, Clan MA(E) Family M1 0.0196 0.0513 1
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0023 0.0044 0.0853
Toxoplasma gondii aminopeptidase n, putative 0.0196 0.0513 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0012 0.0014 0.001
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.094 1
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0012 0.0014 0.001
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0196 0.0513 0.5444
Echinococcus granulosus dnaJ subfamily B 0.0494 0.1324 0.1321
Schistosoma mansoni terminal deoxycytidyl transferase 0.0023 0.0044 0.0044
Loa Loa (eye worm) histone methyltransferase 0.0011 0.001 0.001
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0012 0.0014 0.001
Toxoplasma gondii aminopeptidase N, putative 0.0196 0.0513 1
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0353 0.094 1
Brugia malayi ImpB/MucB/SamB family protein 0.0023 0.0044 0.0095
Trypanosoma brucei DNA polymerase kappa, putative 0.0016 0.0024 0.0469
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.0044 0.0853
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0012 0.0014 0.0014
Trypanosoma cruzi metallo-peptidase, clan MA(E), family M1, putative 0.0196 0.0513 1
Schistosoma mansoni hypothetical protein 0.0165 0.0429 0.0429
Echinococcus multilocularis geminin 0.0165 0.0429 0.0426
Schistosoma mansoni nuclear hormone receptor 0.0012 0.0014 0.0014
Trypanosoma brucei unspecified product 0.0016 0.0024 0.0469
Trypanosoma cruzi DNA polymerase eta, putative 0.0023 0.0044 0.0853
Plasmodium falciparum M1-family alanyl aminopeptidase, putative 0.0196 0.0513 1
Plasmodium falciparum M1-family alanyl aminopeptidase 0.0196 0.0513 1
Loa Loa (eye worm) hypothetical protein 0.0012 0.0014 0.0014
Echinococcus multilocularis cpg binding protein 0.0037 0.008 0.0076
Echinococcus multilocularis aminopeptidase N 0.0196 0.0513 0.0509
Brugia malayi hypothetical protein 0.0196 0.0513 0.1118
Echinococcus multilocularis dna polymerase kappa 0.0023 0.0044 0.004
Loa Loa (eye worm) hypothetical protein 0.0196 0.0513 0.0513
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0012 0.0014 0.0014
Brugia malayi steroid hormone receptor 0.0012 0.0014 0.0029
Trypanosoma brucei Aminopeptidase M1, putative 0.0196 0.0513 1
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.0044 0.0853
Schistosoma mansoni thyroid hormone receptor 0.0012 0.0014 0.0014
Onchocerca volvulus 0.0196 0.0513 1
Brugia malayi hypothetical protein 0.1694 0.4587 1
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0023 0.0044 0.004
Leishmania major puromycin-sensitive aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1 0.0196 0.0513 1
Loa Loa (eye worm) steroid hormone receptor 0.0012 0.0014 0.0014
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0023 0.0044 0.0044
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0012 0.0014 0.001
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0012 0.0014 0.001
Onchocerca volvulus 0.0035 0.0075 0.1225
Loa Loa (eye worm) hypothetical protein 0.0196 0.0513 0.0513
Entamoeba histolytica aminopeptidase, putative 0.0196 0.0513 0.523
Echinococcus granulosus ecdysone induced protein 78C 0.0012 0.0014 0.001
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.094 1
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1 0.0196 0.0513 1
Toxoplasma gondii histone lysine methyltransferase SET1 0.0066 0.0159 0.3102
Schistosoma mansoni cpg binding protein 0.0035 0.0075 0.0075
Loa Loa (eye worm) leukotriene A4 hydrolase 0.3684 1 1
Echinococcus granulosus FTZ F1 alpha 0.0012 0.0014 0.001
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.0044 0.0853
Treponema pallidum fructose-bisphosphate aldolase 0.0353 0.094 0.5
Brugia malayi nuclear receptor NHR-88 0.0012 0.0014 0.0029
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0012 0.0014 0.0014
Trypanosoma cruzi puromycin-sensitive aminopeptidase-like protein, putative 0.0196 0.0513 1
Schistosoma mansoni leukotriene A4 hydrolase (M01 family) 0.3684 1 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0044 0.0853
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0012 0.0014 0.001
Onchocerca volvulus Huntingtin homolog 0.0148 0.0383 0.7397
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0044 0.0853
Schistosoma mansoni aminopeptidase A (M01 family) 0.0196 0.0513 0.0513
Schistosoma mansoni microtubule-associated protein tau 0.0833 0.2247 0.2247
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.0044 0.0853
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0012 0.0014 0.0029
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.094 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0044 0.0853
Brugia malayi CXXC zinc finger family protein 0.0035 0.0075 0.0163
Loa Loa (eye worm) hypothetical protein 0.0012 0.0014 0.0014
Schistosoma mansoni hypothetical protein 0.0165 0.0429 0.0429
Schistosoma mansoni hypothetical protein 0.0494 0.1324 0.1324
Leishmania major DNA polymerase kappa, putative 0.0023 0.0044 0.0853
Brugia malayi TATA binding protein associated factor 0.0196 0.0513 0.1118
Loa Loa (eye worm) hypothetical protein 0.0012 0.0014 0.0014
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0012 0.0014 0.001
Loa Loa (eye worm) hypothetical protein 0.0148 0.0383 0.0383
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0012 0.0014 0.0029
Schistosoma mansoni cytosol alanyl aminopeptidase (M01 family) 0.0196 0.0513 0.0513
Brugia malayi hypothetical protein 0.0148 0.0383 0.0834
Loa Loa (eye worm) hypothetical protein 0.0012 0.0014 0.0014
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0196 0.0513 0.5444
Brugia malayi Peptidase family M1 containing protein 0.0196 0.0513 0.1118
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0023 0.0044 0.004
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0044 0.0853
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0023 0.0044 0.0448
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0012 0.0014 0.0014
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0196 0.0513 0.0509
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0196 0.0513 0.5444
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0196 0.0513 0.0509
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0196 0.0513 0.0509
Loa Loa (eye worm) hypothetical protein 0.0012 0.0014 0.0014
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0044 0.0853
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0012 0.0014 0.001
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0012 0.0014 0.0029
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0012 0.0014 0.0029
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0172 0.0449 0.5
Toxoplasma gondii aminopeptidase N protein 0.0196 0.0513 1
Schistosoma mansoni thyroid hormone receptor 0.0012 0.0014 0.0014
Trypanosoma cruzi aminopeptidase, putative 0.0196 0.0513 1
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0012 0.0014 0.0014
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0196 0.0513 0.0509
Onchocerca volvulus 0.0196 0.0513 1
Loa Loa (eye worm) hypothetical protein 0.0196 0.0513 0.0513
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0012 0.0014 0.0014
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0023 0.0044 0.0044
Loa Loa (eye worm) hypothetical protein 0.0148 0.0383 0.0383
Echinococcus multilocularis microtubule associated protein 2 0.0833 0.2247 0.2244
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0074 0.018 0.018
Schistosoma mansoni retinoic acid receptor RXR 0.0012 0.0014 0.0014
Trypanosoma brucei unspecified product 0.0016 0.0024 0.0469
Onchocerca volvulus 0.0196 0.0513 1
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.0044 0.0853
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0012 0.0014 0.0014
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0012 0.0014 0.0029
Echinococcus multilocularis leukotriene A 4 hydrolase 0.3684 1 1
Echinococcus granulosus dna polymerase eta 0.0023 0.0044 0.004
Echinococcus multilocularis dna polymerase eta 0.0023 0.0044 0.004
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.094 1
Schistosoma mansoni cpg binding protein 0.0037 0.008 0.008

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 4.4563 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Fructose-1,6-bisphosphate Aldolase from Giardia Lamblia. (Class of assay: confirmatory) [Related pubchem assays: 2472, 2464 ] ChEMBL. No reference
Potency (functional) = 4.4668 um PUBCHEM_BIOASSAY: qHTS Multiplex Assay to Identify Dual Action Probes in a Cell Model of Huntington: Aggregate Formation (GFP). (Class of assay: confirmatory) [Related pubchem assays: 1482, 1471 ] ChEMBL. No reference
Potency (functional) = 5.6234 um PUBCHEM_BIOASSAY: VP16 counterscreen qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 7.9433 um PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (binding) = 11.2202 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Thioflavin T Binding. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) = 12.5893 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors Targeting the Menin-MLL Interaction in MLL Related Leukemias: Competition With Texas Red Labeled MLL-derived Mutant Peptide. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 17.7828 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference
Potency (functional) 39.8107 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
Potency (binding) 39.8107 uM PubChem BioAssay. qHTS Assay for Inhibitors of MBNL1-poly(CUG) RNA binding. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 50.1187 uM PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 56.2341 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402] ChEMBL. No reference
Potency (functional) 100 uM PubChem BioAssay. qHTS for Antagonist of cAMP-regulated guanine nucleotide exchange factor 3 (EPAC1): primary screen. (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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