Detailed information for compound 1297054

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 459.537 | Formula: C18H25N3O7S2
  • H donors: 1 H acceptors: 6 LogP: 2.4 Rotable bonds: 10
    Rule of 5 violations (Lipinski): 1
  • SMILES: CSc1ccc(cc1[N+](=O)[O-])S(=O)(=O)NCC(=O)OCC(=O)N1CC(C)CC(C1)C
  • InChi: 1S/C18H25N3O7S2/c1-12-6-13(2)10-20(9-12)17(22)11-28-18(23)8-19-30(26,27)14-4-5-16(29-3)15(7-14)21(24)25/h4-5,7,12-13,19H,6,8-11H2,1-3H3
  • InChiKey: QFZFMLIEANMFDN-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Escherichia coli penicillin-binding protein Starlite/ChEMBL No references
Homo sapiens K(lysine) acetyltransferase 2A Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Candida albicans bromodomain protein similar to S. cerevisiae GCN5 (YGR252W) histone acetyltransferase Get druggable targets OG5_127781 All targets in OG5_127781
Neospora caninum hypothetical protein Get druggable targets OG5_127781 All targets in OG5_127781
Echinococcus granulosus histone acetyltransferase KAT2B Get druggable targets OG5_127781 All targets in OG5_127781
Trichomonas vaginalis bromodomain-containing protein, putative Get druggable targets OG5_127781 All targets in OG5_127781
Schistosoma japonicum ko:K06062 p300/CBP-associated factor, putative Get druggable targets OG5_127781 All targets in OG5_127781
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative Get druggable targets OG5_127781 All targets in OG5_127781
Echinococcus granulosus histone acetyltransferase KAT2B Get druggable targets OG5_127781 All targets in OG5_127781
Plasmodium falciparum histone acetyltransferase GCN5 Get druggable targets OG5_127781 All targets in OG5_127781
Toxoplasma gondii histone lysine acetyltransferase GCN5-B Get druggable targets OG5_127781 All targets in OG5_127781
Mycobacterium tuberculosis Possible penicillin-binding protein Get druggable targets OG5_149948 All targets in OG5_149948
Plasmodium yoelii histone acetyltransferase GCN5-related Get druggable targets OG5_127781 All targets in OG5_127781
Entamoeba histolytica acetyltransferase, GNAT family Get druggable targets OG5_127781 All targets in OG5_127781
Plasmodium berghei histone acetyltransferase GCN5, putative Get druggable targets OG5_127781 All targets in OG5_127781
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis Get druggable targets OG5_127781 All targets in OG5_127781
Plasmodium knowlesi histone acetyltransferase GCN5, putative Get druggable targets OG5_127781 All targets in OG5_127781
Neospora caninum Bromodomain containing protein, related Get druggable targets OG5_127781 All targets in OG5_127781
Cryptosporidium hominis histone acetyltransferase Get druggable targets OG5_127781 All targets in OG5_127781
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 Get druggable targets OG5_127781 All targets in OG5_127781
Theileria parva histone acetyltransferase Gcn5, putative Get druggable targets OG5_127781 All targets in OG5_127781
Candida albicans bromodomain protein similar to S. cerevisiae GCN5 (YGR252W) histone acetyltransferase Get druggable targets OG5_127781 All targets in OG5_127781
Toxoplasma gondii histone lysine acetyltransferase GCN5-A Get druggable targets OG5_127781 All targets in OG5_127781
Babesia bovis histone acetyltransferase Get druggable targets OG5_127781 All targets in OG5_127781
Plasmodium vivax histone acetyltransferase GCN5, putative Get druggable targets OG5_127781 All targets in OG5_127781
Giardia lamblia Histone acetyltransferase GCN5 Get druggable targets OG5_127781 All targets in OG5_127781
Cryptosporidium parvum GCN5 like acetylase + bromodomain Get druggable targets OG5_127781 All targets in OG5_127781
Brugia malayi acetyltransferase, GNAT family protein Get druggable targets OG5_127781 All targets in OG5_127781
Loa Loa (eye worm) acetyltransferase Get druggable targets OG5_127781 All targets in OG5_127781
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) hypothetical protein 0.0255 0.2789 0.6651
Loa Loa (eye worm) hypothetical protein 0.0043 0.0339 0.0649
Plasmodium falciparum importin beta, putative 0.0033 0.0223 0.3915
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0034 0.0224 0.3344
Mycobacterium tuberculosis Probable hydrolase 0.0043 0.0339 0.0889
Loa Loa (eye worm) TAR-binding protein 0.0271 0.2971 0.7098
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0025 0.012 0.3098
Entamoeba histolytica acetyltransferase, GNAT family 0.0047 0.0382 1
Mycobacterium tuberculosis Probable lipase LipE 0.0043 0.0339 0.0889
Mycobacterium tuberculosis Conserved protein 0.0043 0.0339 0.0889
Plasmodium vivax SET domain protein, putative 0.0029 0.0175 0.1738
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0357 0.397 0.9545
Trypanosoma cruzi DNA polymerase eta, putative 0.0048 0.0389 1
Echinococcus granulosus dna polymerase eta 0.0048 0.0389 0.0317
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0074 0.1904
Loa Loa (eye worm) T-complex protein 1 0.0028 0.0161 0.0212
Entamoeba histolytica Ran family GTPase 0.0025 0.012 0.151
Loa Loa (eye worm) RNA binding protein 0.0271 0.2971 0.7098
Brugia malayi T-complex protein 1, beta subunit 0.0028 0.0161 0.0301
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0025 0.012 0.1475
Brugia malayi latrophilin 2 splice variant baaae 0.0255 0.2789 0.6681
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0373 0.4155 1
Schistosoma mansoni hypothetical protein 0.0255 0.2789 0.2735
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0028 0.0162 0.0089
Brugia malayi TAR-binding protein 0.0271 0.2971 0.7124
Schistosoma mansoni tar DNA-binding protein 0.0271 0.2971 0.2918
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0339 0.0267
Echinococcus granulosus GPCR family 2 0.0118 0.1202 0.1137
Entamoeba histolytica hypothetical protein 0.0038 0.027 0.6373
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0051 0.0431 1
Entamoeba histolytica hypothetical protein 0.0038 0.027 0.6373
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0118 0.1202 0.1137
Brugia malayi RNA binding protein 0.0271 0.2971 0.7124
Schistosoma mansoni hypothetical protein 0.0118 0.1202 0.1137
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0148 0.1547 0.1484
Loa Loa (eye worm) beta-lactamase 0.0043 0.0339 0.0649
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0043 0.0339 0.0649
Brugia malayi beta-lactamase family protein 0.0043 0.0339 0.0734
Trypanosoma brucei hypothetical protein, conserved 0.0043 0.0339 0.871
Echinococcus granulosus chaperonin containing TCP1 subunit 2 beta 0.0028 0.0161 0.0087
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0025 0.012 0.151
Leishmania major importin beta-1 subunit, putative 0.0027 0.015 0.2396
Schistosoma mansoni tar DNA-binding protein 0.0271 0.2971 0.2918
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0043 0.0339 0.0889
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0025 0.012 0.0114
Trypanosoma cruzi DNA polymerase eta, putative 0.0034 0.0224 0.4775
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.0339 0.108
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0051 0.0431 0.1457
Echinococcus multilocularis GPCR, family 2 0.0118 0.1202 0.1137
Echinococcus granulosus histone acetyltransferase KAT2B 0.017 0.1805 0.1744
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0074 0.1904
Plasmodium vivax T-complex protein 1 subunit beta, putative 0.0028 0.0161 0.129
Brugia malayi beta-lactamase family protein 0.0043 0.0339 0.0734
Entamoeba histolytica hypothetical protein 0.0027 0.015 0.2453
Echinococcus multilocularis importin subunit beta 1 0.0033 0.0223 0.015
Trypanosoma brucei PAB1-binding protein , putative 0.0027 0.0147 0.3781
Trypanosoma brucei unspecified product 0.0021 0.0074 0.1904
Brugia malayi Calcitonin receptor-like protein seb-1 0.0373 0.4155 1
Loa Loa (eye worm) hypothetical protein 0.0043 0.0339 0.0649
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0118 0.1202 0.1137
Schistosoma mansoni hypothetical protein 0.0357 0.397 0.3925
Leishmania major T-complex protein 1, beta subunit, putative 0.0028 0.0161 0.2748
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0148 0.1547 0.1484
Schistosoma mansoni tar DNA-binding protein 0.0271 0.2971 0.2918
Trypanosoma brucei importin beta-1 subunit, putative 0.0033 0.0223 0.5727
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0118 0.1202 0.1137
Leishmania major DNA polymerase eta, putative 0.0034 0.0224 0.4775
Loa Loa (eye worm) hypothetical protein 0.0027 0.0147 0.0179
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0029 0.0175 0.0101
Leishmania major DNA polymerase eta, putative 0.0048 0.0389 1
Mycobacterium tuberculosis Probable esterase LipL 0.0043 0.0339 0.0889
Plasmodium falciparum T-complex protein 1 subunit beta 0.0028 0.0161 0.1535
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0271 0.2971 0.7098
Schistosoma mansoni hypothetical protein 0.0118 0.1202 0.1137
Brugia malayi Latrophilin receptor protein 2 0.0118 0.1202 0.283
Plasmodium falciparum ataxin-2 like protein, putative 0.0027 0.0147 0.1018
Loa Loa (eye worm) hypothetical protein 0.0043 0.0339 0.0649
Toxoplasma gondii t-complex protein beta subunit 0.0028 0.0161 0.129
Trypanosoma brucei DNA polymerase eta, putative 0.0048 0.0389 1
Trichomonas vaginalis set domain proteins, putative 0.0232 0.2526 1
Trypanosoma brucei DNA polymerase IV, putative 0.0021 0.0074 0.1904
Plasmodium falciparum ataxin-2 like protein, putative 0.0027 0.0147 0.1018
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0148 0.1547 0.1484
Loa Loa (eye worm) hypothetical protein 0.0373 0.4155 1
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0029 0.0175 0.0101
Loa Loa (eye worm) hypothetical protein 0.0029 0.0175 0.0246
Trypanosoma brucei DNA polymerase IV, putative 0.0021 0.0074 0.1904
Echinococcus multilocularis snurportin 1 0.0357 0.397 0.3925
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0051 0.0431 1
Loa Loa (eye worm) acetyltransferase 0.0175 0.1862 0.438
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0025 0.012 0.1475
Trichomonas vaginalis esterase, putative 0.0043 0.0339 0.108
Mycobacterium leprae conserved hypothetical protein 0.0043 0.0339 0.5
Echinococcus multilocularis chaperonin containing TCP1, subunit 2 (beta) 0.0028 0.0161 0.0087
Schistosoma mansoni hypothetical protein 0.0118 0.1202 0.1137
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0074 0.1904
Brugia malayi hypothetical protein 0.0038 0.027 0.0567
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0148 0.1547 0.1484
Echinococcus granulosus histone acetyltransferase KAT2B 0.0051 0.0431 0.036
Toxoplasma gondii LsmAD domain-containing protein 0.0027 0.0147 0.0855
Trypanosoma brucei T-complex protein 1, beta subunit, putative 0.0028 0.0161 0.4129
Schistosoma mansoni importin beta-1 0.0033 0.0223 0.015
Trypanosoma brucei DNA polymerase IV, putative 0.0021 0.0074 0.1904
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0074 0.1904
Schistosoma mansoni DNA polymerase eta 0.0048 0.0389 0.0317
Loa Loa (eye worm) hypothetical protein 0.0043 0.0339 0.0649
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0025 0.012 0.0047
Echinococcus multilocularis dna polymerase eta 0.0048 0.0389 0.0317
Schistosoma mansoni ran 0.0025 0.012 0.0047
Onchocerca volvulus 0.0043 0.0339 0.0699
Brugia malayi beta-lactamase 0.0043 0.0339 0.0734
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0074 0.1904
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0175 0.1862 0.1801
Echinococcus granulosus histone lysine methyltransferase setb 0.0029 0.0175 0.0101
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0339 0.8406
Trichomonas vaginalis chaperonin, putative 0.0028 0.0161 0.0353
Trichomonas vaginalis chaperonin-60kD, ch60, putative 0.0028 0.0161 0.0353
Leishmania major hypothetical protein, conserved 0.0027 0.0147 0.2319
Brugia malayi RNA recognition motif domain containing protein 0.0271 0.2971 0.7124
Trichomonas vaginalis importin beta-1, putative 0.0027 0.015 0.0308
Loa Loa (eye worm) hypothetical protein 0.0118 0.1202 0.2764
Plasmodium vivax hypothetical protein, conserved 0.0043 0.0339 0.7023
Schistosoma mansoni chaperonin containing t-complex protein 1 beta subunit tcpb 0.0028 0.0161 0.0087
Schistosoma mansoni tar DNA-binding protein 0.0271 0.2971 0.2918
Loa Loa (eye worm) hypothetical protein 0.0033 0.0223 0.0364
Trichomonas vaginalis bromodomain-containing protein, putative 0.0051 0.0431 0.1457
Brugia malayi T-complex protein 1, beta subunit 0.0028 0.0161 0.0301
Echinococcus granulosus GTP binding nuclear protein Ran 0.0025 0.012 0.0047
Brugia malayi Importin beta-1 subunit 0.0033 0.0223 0.0452
Mycobacterium ulcerans lipase LipD 0.0043 0.0339 1
Schistosoma mansoni tar DNA-binding protein 0.0271 0.2971 0.2918
Toxoplasma gondii HEAT repeat-containing protein 0.0033 0.0223 0.329
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0175 0.1862 0.1801
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0339 0.108
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0148 0.1547 0.361
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0074 0.1904
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.0339 0.108
Loa Loa (eye worm) hypothetical protein 0.0043 0.0339 0.0649
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0074 0.1904
Leishmania major hypothetical protein, conserved 0.0043 0.0339 0.8406
Brugia malayi RNA, U transporter 1 0.0095 0.0937 0.2185
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0029 0.0175 0.1738
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0278 0.3051 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0175 0.0101
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0118 0.1202 0.283
Giardia lamblia Histone acetyltransferase GCN5 0.0047 0.0382 1
Trypanosoma cruzi PAB1-binding protein , putative 0.0027 0.0147 0.2319
Brugia malayi Pre-SET motif family protein 0.0029 0.0175 0.0335
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0027 0.015 0.0308
Entamoeba histolytica hypothetical protein 0.0038 0.027 0.6373
Brugia malayi Pre-SET motif family protein 0.0204 0.2199 0.5251
Giardia lamblia TCP-1 chaperonin subunit beta 0.0028 0.0161 0.2813
Brugia malayi ImpB/MucB/SamB family protein 0.0048 0.0389 0.0855
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0074 0.1904
Schistosoma mansoni chaperonin containing t-complex protein 1 beta subunit tcpb 0.0028 0.0161 0.0087
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0038 0.027 0.0198
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0148 0.1547 0.1484
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0175 0.0101
Entamoeba histolytica hypothetical protein 0.0038 0.027 0.6373
Schistosoma mansoni ran 0.0025 0.012 0.0047
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0148 0.1547 0.1484
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0043 0.0339 0.0889
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0339 0.8406
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0051 0.0431 1
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0038 0.027 0.0198
Loa Loa (eye worm) latrophilin receptor protein 2 0.0118 0.1202 0.2764
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0339 0.108
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0043 0.0339 1
Onchocerca volvulus 0.0043 0.0339 0.0699
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0074 0.1904
Echinococcus multilocularis beta LACTamase domain containing family member 0.0043 0.0339 0.0267
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0025 0.012 0.0204
Leishmania major GTP-binding protein, putative 0.0025 0.012 0.1475
Loa Loa (eye worm) hypothetical protein 0.0048 0.0389 0.0772
Echinococcus multilocularis tar DNA binding protein 0.0271 0.2971 0.2918
Echinococcus granulosus beta LACTamase domain containing family member 0.0043 0.0339 0.0267
Mycobacterium ulcerans esterase/lipase LipP 0.0043 0.0339 1
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0118 0.1202 0.1137
Mycobacterium tuberculosis Conserved protein 0.0043 0.0339 0.0889
Schistosoma mansoni transcription factor LCR-F1 0.0038 0.027 0.0198
Schistosoma mansoni hypothetical protein 0.0118 0.1202 0.1137
Trypanosoma cruzi PAB1-binding protein , putative 0.0027 0.0147 0.2319
Entamoeba histolytica T-complex protein 1 beta subunit, putative 0.0028 0.0161 0.2813
Trypanosoma cruzi T-complex protein 1, beta subunit, putative 0.0028 0.0161 0.2748
Toxoplasma gondii ABC1 family protein 0.0043 0.0339 0.7023
Mycobacterium tuberculosis Conserved protein 0.0043 0.0339 0.0889
Plasmodium falciparum histone acetyltransferase GCN5 0.0047 0.0382 1
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0204 0.2199 0.5207
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0373 0.4155 1
Echinococcus granulosus tar DNA binding protein 0.0271 0.2971 0.2918
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0148 0.1547 0.1484
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0074 0.1904
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0339 0.0267
Mycobacterium leprae Probable lipase LipE 0.0043 0.0339 0.5
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0339 0.108
Mycobacterium ulcerans beta-lactamase 0.0043 0.0339 1
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0029 0.0175 0.0101
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0043 0.0339 0.0889
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0043 0.0339 0.0734
Plasmodium vivax importin-beta 2, putative 0.0033 0.0223 0.329
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0148 0.1547 0.3668
Mycobacterium ulcerans hypothetical protein 0.0043 0.0339 1
Trichomonas vaginalis ran, putative 0.0025 0.012 0.0189
Echinococcus granulosus snurportin 1 0.0357 0.397 0.3925
Onchocerca volvulus 0.0232 0.2526 1
Loa Loa (eye worm) hypothetical protein 0.0043 0.0339 0.0649
Brugia malayi ImpB/MucB/SamB family protein 0.0021 0.0074 0.0091
Plasmodium vivax ataxin-2 like protein, putative 0.0027 0.0147 0.0855
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0027 0.015 0.0308
Brugia malayi hypothetical protein 0.0027 0.0147 0.0268
Schistosoma mansoni chaperonin containing t-complex protein 1 beta subunit tcpb 0.0028 0.0161 0.0087
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0175 0.0101
Trypanosoma cruzi importin beta-1 subunit, putative 0.0027 0.015 0.2396
Onchocerca volvulus 0.0043 0.0339 0.0699
Trypanosoma brucei importin beta-1 subunit, putative 0.0033 0.0223 0.5727
Mycobacterium tuberculosis Probable lipase LipD 0.0043 0.0339 0.0889
Brugia malayi acetyltransferase, GNAT family protein 0.0175 0.1862 0.4431
Echinococcus granulosus importin subunit beta 1 0.0033 0.0223 0.015
Schistosoma mansoni hypothetical protein 0.0038 0.027 0.0198

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 11.2202 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) 12.5893 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of GCN5L2. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504398] ChEMBL. No reference
Potency (functional) 39.8107 uM PubChem BioAssay. qHTS for Antagonist of cAMP-regulated guanine nucleotide exchange factor 3 (EPAC1): primary screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 50.1187 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference
Potency (functional) 84.9214 uM PubChem BioAssay. qHTS Assay to Find Inhibitors of Pin1. (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.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

No literature references available for this target.

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