Detailed information for compound 1447735

Basic information

Technical information
  • TDR Targets ID: 1447735
  • Name: 2-[3-(2-acetamidophenyl)-2-oxoquinoxalin-1-yl ]-N-(5-chloro-2-methoxyphenyl)acetamide
  • MW: 476.912 | Formula: C25H21ClN4O4
  • H donors: 2 H acceptors: 3 LogP: 3.21 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(cc1NC(=O)Cn1c2ccccc2nc(c1=O)c1ccccc1NC(=O)C)Cl
  • InChi: 1S/C25H21ClN4O4/c1-15(31)27-18-8-4-3-7-17(18)24-25(33)30(21-10-6-5-9-19(21)29-24)14-23(32)28-20-13-16(26)11-12-22(20)34-2/h3-13H,14H2,1-2H3,(H,27,31)(H,28,32)
  • InChiKey: RXSMDXXZTVREMT-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-[3-(2-acetamidophenyl)-2-oxo-quinoxalin-1-yl]-N-(5-chloro-2-methoxy-phenyl)acetamide
  • 2-[3-(2-acetamidophenyl)-2-oxo-1-quinoxalinyl]-N-(5-chloro-2-methoxyphenyl)acetamide
  • 2-[3-(2-acetamidophenyl)-2-keto-quinoxalin-1-yl]-N-(5-chloro-2-methoxy-phenyl)acetamide
  • 2-[3-(2-acetamidophenyl)-2-oxo-quinoxalin-1-yl]-N-(5-chloro-2-methoxy-phenyl)ethanamide
  • D384-0125
  • NCGC00119580-01

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens bromodomain adjacent to zinc finger domain, 2B Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus multilocularis bromodomain adjacent to zinc finger domain Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma japonicum Cleft lip and palate transmembrane protein 1-like protein, putative Get druggable targets OG5_131570 All targets in OG5_131570
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma japonicum hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma mansoni bromodomain containing protein Get druggable targets OG5_131570 All targets in OG5_131570
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma japonicum Conserved hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma japonicum expressed protein Get druggable targets OG5_131570 All targets in OG5_131570
Brugia malayi Bromodomain containing protein Get druggable targets OG5_131570 All targets in OG5_131570
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma japonicum ko:K01549 ATP synthase [EC3.6.3.14], putative Get druggable targets OG5_131570 All targets in OG5_131570
Echinococcus granulosus bromodomain adjacent to zinc finger domain Get druggable targets OG5_131570 All targets in OG5_131570
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
Echinococcus multilocularis jumonji domain containing protein 0.0041 0.0397 0.0368
Brugia malayi mbt repeat family protein 0.0048 0.0503 0.1327
Trypanosoma cruzi DNA polymerase eta, putative 0.0038 0.0351 0.0757
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0049 0.0525 0.0495
Brugia malayi jmjC domain containing protein 0.0044 0.0443 0.1168
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.0089 0.1115 0.2561
Brugia malayi jmjC domain containing protein 0.0224 0.3106 0.8199
Echinococcus granulosus jumonji domain containing 1A 0.0044 0.0443 0.0413
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0301 0.0795
Loa Loa (eye worm) RecQ helicase 0.0021 0.0113 0.0298
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0043 0.0425 0.0932
Toxoplasma gondii exonuclease III APE 0.0019 0.0076 0.0608
Leishmania major DNA polymerase eta, putative 0.0038 0.0351 0.0757
Brugia malayi Bromodomain containing protein 0.0164 0.2217 0.5851
Brugia malayi ImpB/MucB/SamB family protein 0.0064 0.0745 0.1966
Echinococcus granulosus histone lysine methyltransferase setb 0.0067 0.0789 0.0761
Mycobacterium tuberculosis Conserved protein 0.0036 0.033 0.0943
Loa Loa (eye worm) pigment dispersing factor receptor c 0.005 0.0535 0.1411
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0066 0.0773 0.1754
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0029 0.0229 0.0198
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0303 0.4263 1
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.0066 0.0773 0.2041
Brugia malayi Apoptosis regulator proteins, Bcl-2 family protein 0.0083 0.1022 0.2697
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.0066 0.0773 0.1754
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0192 0.2633 0.261
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0303 0.4263 1
Echinococcus granulosus dna polymerase eta 0.0064 0.0745 0.0716
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.0089 0.1115 0.257
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0036 0.033 0.0943
Trypanosoma brucei unspecified product 0.0039 0.0368 0.0797
Toxoplasma gondii PHD-finger domain-containing protein 0.0029 0.0229 0.1991
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.0368 0.0797
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0054 0.06 0.1585
Mycobacterium tuberculosis Conserved hypothetical protein 0.016 0.2149 0.6688
Onchocerca volvulus 0.0036 0.033 0.033
Mycobacterium ulcerans esterase/lipase LipP 0.0036 0.033 0.1226
Schistosoma mansoni bcl-2 homologous antagonist/killer (bak) 0.0083 0.1022 0.0994
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0271 0.3789 0.377
Trypanosoma brucei cysteine peptidase C (CPC) 0.0089 0.1115 0.2561
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0271 0.3789 0.377
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0019 0.0076 0.014
Echinococcus multilocularis Jumonji, AT rich interactive domain 1B 0.0048 0.0504 0.0475
Schistosoma mansoni DNA polymerase eta 0.0064 0.0745 0.0716
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0039 0.0368 0.0338
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0293 0.4119 1
Schistosoma mansoni phosphatidylserine receptor 0.0044 0.0443 0.0413
Loa Loa (eye worm) hypothetical protein 0.0036 0.033 0.087
Brugia malayi cathepsin B-like cysteine proteinase 0.0271 0.3789 1
Schistosoma mansoni ap endonuclease 0.0019 0.0076 0.0045
Echinococcus granulosus expressed protein 0.0033 0.0291 0.0261
Mycobacterium ulcerans lipase LipD 0.0036 0.033 0.1226
Loa Loa (eye worm) latrophilin receptor protein 2 0.0016 0.0031 0.0081
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0293 0.4119 1
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0066 0.0773 0.1754
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0039 0.0368 0.0338
Brugia malayi Bromodomain containing protein 0.0084 0.1033 0.2726
Toxoplasma gondii peptidylprolyl isomerase 0.0033 0.028 0.2453
Brugia malayi mbt repeat family protein 0.0048 0.0503 0.1327
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0143 0.1908 0.8838
Trichomonas vaginalis DNA helicase recq, putative 0.0021 0.0113 0.0093
Brugia malayi PHD-finger family protein 0.0029 0.0229 0.0603
Giardia lamblia PHD finger protein 15 0.0029 0.0229 0.0378
Brugia malayi isocitrate dehydrogenase 0.0016 0.0031 0.0082
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0036 0.033 0.03
Loa Loa (eye worm) jmjC domain-containing protein 0.006 0.0687 0.1815
Brugia malayi jmjC domain containing protein 0.0044 0.0443 0.1168
Echinococcus multilocularis histone acetyltransferase MYST2 0.0054 0.06 0.0571
Schistosoma mansoni jumonji domain containing protein 0.0205 0.2816 0.2794
Schistosoma mansoni jumonji/arid domain-containing protein 0.0168 0.2278 0.2254
Trichomonas vaginalis penicillin-binding protein, putative 0.0036 0.033 0.0629
Schistosoma mansoni blooms syndrome DNA helicase 0.0017 0.0047 0.0016
Echinococcus granulosus JmjC domain containing protein 4 0.0044 0.0443 0.0413
Schistosoma mansoni myelin transcription factor 1 myt1 0.0054 0.06 0.0571
Echinococcus granulosus zinc finger protein 0.0043 0.0429 0.0399
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, putative 0.0033 0.028 0.0505
Echinococcus multilocularis Bcl 2 ous antagonist:killer 0.0083 0.1022 0.0994
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0079 0.0957 0.0929
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.0066 0.0773 0.2041
Loa Loa (eye worm) hypothetical protein 0.0017 0.0049 0.013
Loa Loa (eye worm) hypothetical protein 0.0271 0.3789 1
Echinococcus granulosus PHD finger protein rhinoceros 0.0029 0.0229 0.0198
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0271 0.3789 0.377
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0019 0.0075 0.1059
Onchocerca volvulus 0.003 0.0239 0.0034
Trypanosoma brucei DNA polymerase IV, putative 0.0039 0.0368 0.0797
Toxoplasma gondii isocitrate dehydrogenase 0.0016 0.0031 0.0206
Brugia malayi Bloom's syndrome protein homolog 0.0021 0.0113 0.0298
Echinococcus multilocularis EGFP:Bcl2 fusion protein 0.0083 0.1022 0.0994
Loa Loa (eye worm) bromodomain containing protein 0.0039 0.0367 0.097
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0019 0.0076 0.0045
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0019 0.0076 0.0105
Brugia malayi Pre-SET motif family protein 0.003 0.0239 0.063
Echinococcus granulosus cathepsin b 0.0271 0.3789 0.377
Schistosoma mansoni hypothetical protein 0.0033 0.0291 0.0261
Schistosoma mansoni methyl-cpg binding protein mbd 0.0037 0.0348 0.0318
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0049 0.0525 0.0495
Trypanosoma brucei ISWI complex protein 0.0033 0.0291 0.0614
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0054 0.06 0.0571
Brugia malayi Pin1-type peptidyl-prolyl cis-trans isomerase, BmPin1 0.0033 0.0291 0.0769
Loa Loa (eye worm) hypothetical protein 0.0036 0.033 0.087
Schistosoma mansoni protein phosphatase 2C 0.0044 0.0443 0.0413
Brugia malayi exodeoxyribonuclease III family protein 0.0019 0.0076 0.0199
Brugia malayi Bromodomain containing protein 0.0034 0.0305 0.0805
Mycobacterium ulcerans DNA polymerase IV 0.0039 0.0368 0.1411
Leishmania major hypothetical protein, conserved 0.0036 0.033 0.0706
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0043 0.0425 0.0932
Schistosoma mansoni bromodomain containing protein 0.0138 0.1839 0.1814
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0019 0.0076 0.5
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0131 0.1723 0.1698
Echinococcus multilocularis SAM and MBT domain containing protein 0.0048 0.0503 0.0473
Onchocerca volvulus 0.0048 0.0503 0.0893
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0224 0.3106 0.3085
Leishmania major hypothetical protein, conserved 0.0033 0.0291 0.0614
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0039 0.0368 0.0797
Trichomonas vaginalis D-aminoacylase, putative 0.0036 0.033 0.0629
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0036 0.033 0.087
Mycobacterium ulcerans hypothetical protein 0.0036 0.033 0.1226
Entamoeba histolytica deoxycytidyl transferase, putative 0.0039 0.0368 0.0724
Trypanosoma cruzi DNA polymerase kappa, putative 0.0039 0.0368 0.0797
Loa Loa (eye worm) isocitrate dehydrogenase 0.0016 0.0031 0.0082
Echinococcus multilocularis jumonji domain containing 1A 0.0044 0.0443 0.0413
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.0368 0.0797
Echinococcus multilocularis zinc finger protein 0.0043 0.0429 0.0399
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0054 0.06 0.0571
Brugia malayi jmjC domain containing protein 0.0168 0.2278 0.6012
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0293 0.4119 1
Loa Loa (eye worm) hypothetical protein 0.0064 0.0745 0.1966
Schistosoma mansoni jumonji/arid domain-containing protein 0.0168 0.2278 0.2254
Trichomonas vaginalis conserved hypothetical protein 0.0033 0.0291 0.0534
Giardia lamblia Fructose-bisphosphate aldolase 0.0293 0.4119 1
Echinococcus multilocularis expressed protein 0.0033 0.0291 0.0261
Schistosoma mansoni phd/f-box containing protein 0.0044 0.0443 0.0413
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0076 0.1081
Trichomonas vaginalis DNA polymerase eta, putative 0.0039 0.0368 0.0724
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0143 0.1911 0.4442
Schistosoma mansoni sex comb on midleg homolog 0.0048 0.0503 0.0473
Trypanosoma cruzi DNA polymerase kappa, putative 0.0039 0.0368 0.0797
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0143 0.1911 0.4442
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0016 0.0031 0.0469
Echinococcus granulosus histone acetyltransferase MYST2 0.0054 0.06 0.0571
Echinococcus multilocularis JmjC domain containing protein 4 0.0044 0.0443 0.0413
Loa Loa (eye worm) PHD-finger family protein 0.0045 0.0463 0.1222
Brugia malayi ImpB/MucB/SamB family protein 0.0039 0.0368 0.0972
Plasmodium vivax JmjC domain containing protein 0.0044 0.0443 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0293 0.4119 1
Mycobacterium tuberculosis Probable lipase LipE 0.0036 0.033 0.0943
Mycobacterium tuberculosis Conserved protein 0.0036 0.033 0.0943
Trypanosoma cruzi ISWI complex protein 0.0033 0.0291 0.0614
Loa Loa (eye worm) hypothetical protein 0.0036 0.033 0.087
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0192 0.2633 0.261
Echinococcus multilocularis lysine specific demethylase 6a 0.0044 0.0443 0.0413
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.0368 0.0797
Loa Loa (eye worm) hypothetical protein 0.0093 0.1173 0.3096
Schistosoma mansoni sex comb on midleg homolog 0.0048 0.0503 0.0473
Loa Loa (eye worm) jmjC domain-containing protein 0.0044 0.0443 0.1168
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.0368 0.0797
Loa Loa (eye worm) hypothetical protein 0.0044 0.0443 0.1168
Echinococcus multilocularis polycomb protein SCMH1 0.0048 0.0503 0.0473
Echinococcus granulosus polycomb protein SCMH1 0.0048 0.0503 0.0473
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.005 0.0535 0.1411
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0043 0.0425 0.0932
Mycobacterium tuberculosis Probable esterase LipL 0.0036 0.033 0.0943
Toxoplasma gondii histone lysine demethylase JMJC1/KDM5D/JARID1D 0.0044 0.0443 0.3925
Treponema pallidum fructose-bisphosphate aldolase 0.0293 0.4119 1
Onchocerca volvulus 0.0036 0.033 0.033
Echinococcus multilocularis microtubule associated protein 2 0.0692 1 1
Loa Loa (eye worm) hypothetical protein 0.0034 0.0301 0.0795
Schistosoma mansoni ubiquitously transcribed sex (X/Y) chromosome tetratricopeptide repeat protein-related 0.0044 0.0443 0.0413
Trichomonas vaginalis penicillin-binding protein, putative 0.0036 0.033 0.0629
Echinococcus multilocularis cathepsin b 0.0271 0.3789 0.377
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0079 0.0957 0.0929
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0143 0.1908 1
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0036 0.033 0.1226
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.0066 0.0773 0.0745
Echinococcus multilocularis phd:f box containing protein 0.0044 0.0443 0.0413
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.0368 0.0797
Brugia malayi Pre-SET motif family protein 0.0209 0.2874 0.7587
Loa Loa (eye worm) hypothetical protein 0.005 0.0535 0.1411
Echinococcus multilocularis PHD finger protein rhinoceros 0.0029 0.0229 0.0198
Schistosoma mansoni jumonji domain containing protein 0.0044 0.0443 0.0413
Echinococcus granulosus phd:f box containing protein 0.0044 0.0443 0.0413
Mycobacterium tuberculosis Conserved hypothetical protein 0.0039 0.0368 0.1064
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0019 0.0076 0.0105
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0239 0.0209
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0052 0.0563 0.1256
Leishmania major DNA polymerase kappa, putative 0.0039 0.0368 0.0797
Toxoplasma gondii ABC1 family protein 0.0036 0.033 0.2906
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0048 0.0503 0.0473
Schistosoma mansoni hypothetical protein 0.0083 0.1022 0.0994
Schistosoma mansoni SmCB2 peptidase (C01 family) 0.0271 0.3789 0.377
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.033 0.0706
Trypanosoma cruzi ISWI complex protein 0.0033 0.0291 0.0614
Trichomonas vaginalis D-aminoacylase, putative 0.0036 0.033 0.0629
Loa Loa (eye worm) hypothetical protein 0.0048 0.0503 0.1327
Brugia malayi Latrophilin receptor protein 2 0.0016 0.0031 0.0081
Toxoplasma gondii PHD-finger domain-containing protein 0.0029 0.0229 0.1991
Loa Loa (eye worm) hypothetical protein 0.0036 0.033 0.087
Giardia lamblia Cathepsin B precursor 0.0089 0.1115 0.257
Mycobacterium tuberculosis Probable hydrolase 0.0036 0.033 0.0943
Echinococcus granulosus peregrin 0.0034 0.0305 0.0275
Trypanosoma brucei DNA polymerase kappa, putative 0.0027 0.0191 0.0378
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0293 0.4119 1
Brugia malayi jmjC domain containing protein 0.0044 0.0443 0.1168
Loa Loa (eye worm) mbt repeat family protein 0.0048 0.0503 0.1327
Mycobacterium tuberculosis Conserved protein 0.0036 0.033 0.0943
Leishmania major peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative 0.0033 0.028 0.0588
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0039 0.0368 0.0972
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0224 0.3106 0.3085
Brugia malayi jmjC domain containing protein 0.0044 0.0443 0.1168
Trichomonas vaginalis set domain proteins, putative 0.0238 0.33 0.7974
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0019 0.0076 0.0199
Leishmania major cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like 0.0089 0.1115 0.2561
Echinococcus granulosus fetal alzheimer antigen falz 0.0049 0.0525 0.0495
Echinococcus granulosus dna polymerase kappa 0.0039 0.0368 0.0338
Schistosoma mansoni hypothetical protein 0.0083 0.1022 0.0994
Trypanosoma cruzi DNA polymerase kappa, putative 0.0039 0.0368 0.0797
Loa Loa (eye worm) hypothetical protein 0.0016 0.0031 0.0081
Echinococcus granulosus transcription factor Dp 1 0.0038 0.0362 0.0333
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0036 0.033 0.0943
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.0368 0.0797
Brugia malayi PHD-finger family protein 0.0054 0.0601 0.1586
Loa Loa (eye worm) cathepsin B 0.0089 0.1115 0.2942
Loa Loa (eye worm) hypothetical protein 0.0084 0.1042 0.2751
Schistosoma mansoni microtubule-associated protein tau 0.0692 1 1
Schistosoma mansoni hypothetical protein 0.0034 0.0301 0.0271
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0038 0.0351 0.31
Onchocerca volvulus 0.0238 0.33 1
Trypanosoma cruzi DNA polymerase kappa, putative 0.0039 0.0368 0.0797
Toxoplasma gondii histone lysine demethylase JMJD6a 0.0044 0.0443 0.3925
Trichomonas vaginalis D-aminoacylase, putative 0.0036 0.033 0.0629
Echinococcus multilocularis beta LACTamase domain containing family member 0.0036 0.033 0.03
Trypanosoma brucei peptidyl-prolyl cis-trans isomerase/rotamase, putative 0.0033 0.028 0.0588
Trypanosoma brucei DNA polymerase IV, putative 0.0039 0.0368 0.0797
Trypanosoma brucei DNA polymerase IV, putative 0.0039 0.0368 0.0797
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0293 0.4119 1
Schistosoma mansoni hypothetical protein 0.0029 0.0229 0.0198
Echinococcus multilocularis bloom syndrome protein 0.0021 0.0113 0.0083
Echinococcus granulosus lysine specific demethylase 5A 0.0168 0.2278 0.2254
Trichomonas vaginalis DNA helicase recq1, putative 0.0021 0.0113 0.0093
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0039 0.0368 0.1064
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.033 0.0706
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0293 0.4119 1
Toxoplasma gondii hypothetical protein 0.0049 0.0518 0.4604
Echinococcus multilocularis dna polymerase kappa 0.0039 0.0368 0.0338
Echinococcus granulosus lysine specific demethylase 6a 0.0044 0.0443 0.0413
Trichomonas vaginalis rotamase, putative 0.0033 0.028 0.0505
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.003 0.0239 0.2084
Echinococcus granulosus SAM and MBT domain containing protein 0.0048 0.0503 0.0473
Mycobacterium ulcerans hypothetical protein 0.016 0.2149 1
Echinococcus granulosus methyl CpG binding domain protein 2 0.0037 0.0348 0.0318
Trypanosoma brucei DNA polymerase kappa, putative 0.0027 0.0191 0.0378
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0036 0.033 0.03
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.0368 0.0797
Loa Loa (eye worm) hypothetical protein 0.0155 0.2079 0.5487
Giardia lamblia Cathepsin B precursor 0.0089 0.1115 0.257
Loa Loa (eye worm) hypothetical protein 0.0054 0.06 0.1585
Echinococcus granulosus Bcl 2 ous antagonist:killer 0.0083 0.1022 0.0994
Schistosoma mansoni hypothetical protein 0.0045 0.0463 0.0434
Trypanosoma brucei JmjC domain, hydroxylase, putative 0.0044 0.0443 0.0972
Trichomonas vaginalis esterase, putative 0.0036 0.033 0.0629
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0231 0.3198 1
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0039 0.0368 0.0724
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0019 0.0076 0.0105
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0039 0.0368 0.0338
Loa Loa (eye worm) hypothetical protein 0.0029 0.0229 0.0603
Loa Loa (eye worm) hypothetical protein 0.0089 0.1112 0.2934
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0209 0.2874 0.7587
Brugia malayi beta-lactamase family protein 0.0036 0.033 0.087
Loa Loa (eye worm) Pin1-type peptidyl-prolyl cis-trans isomerase 0.0033 0.0291 0.0769
Loa Loa (eye worm) jmjC domain-containing protein 0.0044 0.0443 0.1168
Mycobacterium tuberculosis Probable lipase LipD 0.0036 0.033 0.0943
Loa Loa (eye worm) jmjC domain-containing protein 0.0044 0.0443 0.1168
Schistosoma mansoni rotamase 0.0033 0.0291 0.0261
Echinococcus granulosus Jumonji AT rich interactive domain 1B 0.0048 0.0504 0.0475
Giardia lamblia Cathepsin B precursor 0.0089 0.1115 0.257
Echinococcus granulosus bloom syndrome protein 0.0021 0.0113 0.0083
Echinococcus multilocularis dna polymerase eta 0.0064 0.0745 0.0716
Schistosoma mansoni methyl-cpg binding protein mbd 0.0037 0.0348 0.0318
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0067 0.0789 0.0761
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.0271 0.3789 0.888
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.0368 0.0797
Trypanosoma cruzi JmjC domain, hydroxylase, putative 0.0044 0.0443 0.0972
Brugia malayi beta-lactamase 0.0036 0.033 0.087
Brugia malayi beta-lactamase family protein 0.0036 0.033 0.087
Schistosoma mansoni hypothetical protein 0.0083 0.1022 0.0994
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0016 0.0031 0.0081
Echinococcus granulosus cathepsin b 0.0271 0.3789 0.377
Onchocerca volvulus 0.0036 0.033 0.033
Loa Loa (eye worm) hypothetical protein 0.0067 0.0789 0.2082
Plasmodium falciparum JmjC domain-containing protein, putative 0.0044 0.0443 1
Schistosoma mansoni ap endonuclease 0.0019 0.0076 0.0045
Loa Loa (eye worm) apoptosis regulator protein 0.0083 0.1022 0.2697
Leishmania major mitochondrial DNA polymerase beta 0.0303 0.4263 1
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0036 0.033 0.0943
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0019 0.0076 0.0105
Trypanosoma cruzi JmjC domain, hydroxylase, putative 0.0044 0.0443 0.0972
Giardia lamblia DINP protein human, muc B family 0.0039 0.0368 0.0724
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.0368 0.0797
Brugia malayi Isocitrate dehydrogenase 0.0016 0.0031 0.0082
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0067 0.0789 0.0761
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0043 0.0425 0.0932
Echinococcus multilocularis transcription factor Dp 1 0.0038 0.0362 0.0333
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0066 0.0773 0.1754
Plasmodium vivax hypothetical protein, conserved 0.0029 0.0229 0.5043
Loa Loa (eye worm) jmjC domain-containing protein 0.0168 0.2278 0.6012
Plasmodium falciparum phd finger protein, putative 0.0029 0.0229 0.4799
Brugia malayi F/Y-rich N-terminus family protein 0.0015 0.0016 0.0043
Loa Loa (eye worm) hypothetical protein 0.0084 0.1035 0.2732
Trypanosoma brucei hypothetical protein, conserved 0.0036 0.033 0.0706
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0293 0.4119 1
Loa Loa (eye worm) hypothetical protein 0.0083 0.1022 0.2697
Trypanosoma brucei unspecified product 0.0027 0.0191 0.0378
Toxoplasma gondii isocitrate dehydrogenase 0.0016 0.0031 0.0206
Loa Loa (eye worm) beta-lactamase 0.0036 0.033 0.087
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase 0.0033 0.028 0.0588
Trypanosoma brucei DNA polymerase kappa, putative 0.0027 0.0191 0.0378
Toxoplasma gondii cathepsin B 0.0089 0.1115 1
Mycobacterium ulcerans beta-lactamase 0.0036 0.033 0.1226
Schistosoma mansoni zinc finger protein 0.0043 0.0429 0.0399
Echinococcus granulosus beta LACTamase domain containing family member 0.0036 0.033 0.03
Leishmania major DNA polymerase eta, putative 0.0064 0.0745 0.1687
Trypanosoma cruzi DNA polymerase eta, putative 0.0064 0.0745 0.1687
Echinococcus multilocularis peregrin 0.0034 0.0305 0.0275
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.003 0.0239 0.0209
Trypanosoma brucei DNA polymerase eta, putative 0.0064 0.0745 0.1687
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0143 0.1908 0.5927
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.0066 0.0773 0.0745
Schistosoma mansoni zinc finger protein 0.0033 0.0291 0.0261
Schistosoma mansoni apoptosis regulator bax 0.0083 0.1022 0.0994
Echinococcus granulosus EGFP:Bcl2 fusion protein 0.0083 0.1022 0.0994
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.003 0.0239 0.0209
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0293 0.4119 1
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0076 0.15
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0036 0.033 0.087
Leishmania major hypothetical protein, conserved 0.0044 0.0443 0.0972
Loa Loa (eye worm) PHD-finger family protein 0.0029 0.0229 0.0603
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0089 0.1115 0.1087
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0037 0.0348 0.0318
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0019 0.0076 0.0045
Schistosoma mansoni hypothetical protein 0.0295 0.4141 0.4123
Loa Loa (eye worm) hypothetical protein 0.0044 0.0443 0.1168
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.0066 0.0773 0.0745
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0143 0.1911 0.4442
Trichomonas vaginalis rotamase, putative 0.0033 0.0291 0.0534
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0067 0.0789 0.0761
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0293 0.4119 1
Echinococcus multilocularis lysine specific demethylase 5A 0.0164 0.2216 0.2192
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.0368 0.0797
Loa Loa (eye worm) hypothetical protein 0.0036 0.033 0.087
Schistosoma mansoni terminal deoxycytidyl transferase 0.0039 0.0368 0.0338
Plasmodium vivax SET domain protein, putative 0.003 0.0239 0.5282
Echinococcus multilocularis cathepsin b 0.0271 0.3789 0.377
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0303 0.4263 1
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0131 0.1723 0.1698
Loa Loa (eye worm) hypothetical protein 0.0036 0.033 0.087
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase 0.0033 0.028 0.0588
Trypanosoma brucei unspecified product 0.0027 0.0191 0.0378
Mycobacterium ulcerans DNA polymerase IV 0.0039 0.0368 0.1411
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.0066 0.0773 0.1726
Brugia malayi Calcitonin receptor-like protein seb-1 0.005 0.0535 0.1411
Loa Loa (eye worm) MBCTL1 0.0054 0.06 0.1585
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0029 0.0223 0.0192
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0048 0.0503 0.0893
Echinococcus granulosus jumonji domain containing protein 0.0041 0.0397 0.0368
Plasmodium vivax hypothetical protein, conserved 0.0036 0.033 0.7389

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.7079 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] ChEMBL. No reference
Potency (functional) 29.0929 uM PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] ChEMBL. No reference
Potency (functional) = 100 um PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))] ChEMBL. No reference
Potency (functional) 100 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

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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