Detailed information for compound 458311

Basic information

Technical information
  • TDR Targets ID: 458311
  • Name: tert-butyl 2-[2-(benzenesulfonamido)-2,3-dihy dro-1H-inden-5-yl]-5-hydroxyindole-1-carboxyl ate
  • MW: 504.597 | Formula: C28H28N2O5S
  • H donors: 2 H acceptors: 4 LogP: 5.6 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 2
  • SMILES: Oc1ccc2c(c1)cc(n2C(=O)OC(C)(C)C)c1ccc2c(c1)CC(C2)NS(=O)(=O)c1ccccc1
  • InChi: 1S/C28H28N2O5S/c1-28(2,3)35-27(32)30-25-12-11-23(31)16-21(25)17-26(30)19-10-9-18-14-22(15-20(18)13-19)29-36(33,34)24-7-5-4-6-8-24/h4-13,16-17,22,29,31H,14-15H2,1-3H3
  • InChiKey: GPMOKHWGTGSTLL-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • tert-butyl 2-[2-(benzenesulfonamido)indan-5-yl]-5-hydroxy-indole-1-carboxylate
  • 2-[2-(benzenesulfonamido)-5-indanyl]-5-hydroxy-1-indolecarboxylic acid tert-butyl ester
  • tert-butyl 5-hydroxy-2-[2-(phenylsulfonylamino)-2,3-dihydro-1H-inden-5-yl]indole-1-carboxylate
  • 2-[2-(benzenesulfonamido)indan-5-yl]-5-hydroxy-indole-1-carboxylic acid tert-butyl ester

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
Loa Loa (eye worm) histone deacetylase 11 0.0013 0.0002 0.0002
Trypanosoma cruzi cysteine peptidase, Clan CA, family C54, putative 0.0023 0.0015 0.0039
Leishmania major AUT2/APG4/ATG4 cysteine peptidase, putative 0.0023 0.0015 0.0039
Loa Loa (eye worm) hypothetical protein 0.005 0.0052 0.0052
Brugia malayi Phospholipase A2 family protein 0.0092 0.0107 0.0107
Loa Loa (eye worm) hypothetical protein 0.0017 0.0008 0.0008
Trypanosoma cruzi histone deacetylase, putative 0.0013 0.0002 0.0005
Echinococcus multilocularis nibrin 0.0019 0.001 0.0099
Echinococcus granulosus histone deacetylase 0.0043 0.0042 0.0986
Trichomonas vaginalis chromosome transmission fidelity factor, putative 0.0019 0.001 0.1641
Loa Loa (eye worm) hypothetical protein 0.0019 0.001 0.001
Wolbachia endosymbiont of Brugia malayi NAD-dependent DNA ligase, Lig 0.0019 0.001 0.001
Plasmodium falciparum cysteine protease ATG4, putative 0.0023 0.0015 0.3624
Toxoplasma gondii histone deacetylase HDAC2 0.0013 0.0002 0.043
Loa Loa (eye worm) latrophilin receptor protein 2 0.0015 0.0005 0.0005
Schistosoma mansoni BC026374 protein (S09 family) 0.0012 0 0.0012
Echinococcus granulosus Protein patched homolog 1 0.0041 0.004 0.0932
Onchocerca volvulus 0.0019 0.001 0.0183
Echinococcus granulosus sterol regulatory element binding protein 0.0041 0.004 0.0932
Echinococcus multilocularis transient receptor potential cation channel 0.0161 0.02 0.1922
Schistosoma mansoni histone deacetylase 4 5 0.0043 0.0042 0.2143
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase 0.0059 0.0063 1
Trichomonas vaginalis histone deacetylase, putative 0.0013 0.0002 0.0285
Entamoeba histolytica hypothetical protein 0.0106 0.0127 1
Schistosoma mansoni hypothetical protein 0.0015 0.0005 0.0254
Entamoeba histolytica acyl-coA synthetase, putative 0.0023 0.0015 0.122
Schistosoma mansoni family C54 unassigned peptidase (C54 family) 0.0059 0.0063 0.3226
Plasmodium vivax replication factor C subunit 1, putative 0.0019 0.001 0.2471
Trypanosoma brucei histone deacetylase 4 0.0043 0.0042 0.0107
Loa Loa (eye worm) hypothetical protein 0.0069 0.0077 0.0077
Brugia malayi Pax transcription activation domain interacting protein 0.0019 0.001 0.001
Giardia lamblia Histone deacetylase 0.0013 0.0002 0.1738
Brugia malayi CHE-14 protein 0.0041 0.004 0.004
Onchocerca volvulus 0.0012 0 0.0004
Trypanosoma cruzi histone deacetylase, putative 0.0043 0.0042 0.0107
Entamoeba histolytica peptidase, C54 family 0.0023 0.0015 0.1198
Echinococcus granulosus acetylcholinesterase 0.0069 0.0077 0.1819
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0023 0.0015 1
Mycobacterium tuberculosis Carboxylesterase LipT 0.0012 0 0.0003
Brugia malayi hypothetical protein 0.023 0.0292 0.0292
Brugia malayi Latrophilin receptor protein 2 0.0015 0.0005 0.0005
Leishmania major histone deacetylase, putative 0.0013 0.0002 0.0005
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0097 0.0115 0.5873
Echinococcus multilocularis family S9 non peptidase ue (S09 family) 0.0012 0 0.0002
Trichomonas vaginalis chromosome transmission fidelity factor, putative 0.0019 0.001 0.1641
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0017 0.0008 0.0105
Echinococcus multilocularis histone deacetylase 6 0.0049 0.0051 0.0487
Onchocerca volvulus Phospholipase A2 homolog 0.0092 0.0107 0.189
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0012 0 0.0012
Toxoplasma gondii histone deacetylase HDAC5 0.0013 0.0002 0.0507
Echinococcus granulosus acetylcholinesterase 0.0069 0.0077 0.1819
Echinococcus multilocularis acetylcholinesterase 0.0069 0.0077 0.0742
Loa Loa (eye worm) histone deacetylase 3 0.0013 0.0002 0.0002
Echinococcus multilocularis sterol regulatory element binding protein 0.0041 0.004 0.038
Trypanosoma cruzi histone deacetylase, putative 0.0013 0.0002 0.0005
Echinococcus multilocularis BC026374 protein (S09 family) 0.0012 0 0.0002
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0044 0.2259
Loa Loa (eye worm) hypothetical protein 0.0033 0.0029 0.0029
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0044 0.0424
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.0047 0.0047
Echinococcus multilocularis histone deacetylase 7 0.0043 0.0042 0.0402
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.0015 0.0211
Trypanosoma cruzi hypothetical protein, conserved 0.0019 0.001 0.0026
Schistosoma mansoni histone deacetylase hda2 0.0013 0.0002 0.0092
Loa Loa (eye worm) hypothetical protein 0.0048 0.0049 0.0049
Schistosoma mansoni hypothetical protein 0.0015 0.0005 0.0254
Plasmodium falciparum histone deacetylase 1 0.0013 0.0002 0.043
Plasmodium vivax histone deacetylase 1, putative 0.0013 0.0002 0.043
Schistosoma mansoni hypothetical protein 0.004 0.0038 0.1924
Brugia malayi latrophilin 2 splice variant baaae 0.0033 0.0029 0.0029
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0015 0.0005 0.0048
Brugia malayi histone deacetylase 1 (HD1) 0.0013 0.0002 0.0002
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0016 0.0006 0.0087
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0044 0.0424
Loa Loa (eye worm) hypothetical protein 0.0017 0.0008 0.0008
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase 0.0059 0.0063 1
Plasmodium vivax histone deacetylase, putative 0.0013 0.0002 0.043
Entamoeba histolytica hypothetical protein 0.0106 0.0127 1
Echinococcus granulosus neuroligin 0.0012 0 0.0005
Loa Loa (eye worm) hypothetical protein 0.0048 0.0049 0.0049
Entamoeba histolytica acyl-CoA synthetase, putative 0.0023 0.0015 0.122
Trypanosoma brucei histone deacetylase 3 0.0043 0.0042 0.0107
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.001 0.1641
Schistosoma mansoni hypothetical protein 0.004 0.0038 0.1924
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0044 0.2259
Echinococcus multilocularis replication factor c subunit 1 0.0019 0.001 0.0099
Echinococcus granulosus carboxylesterase 5A 0.0069 0.0077 0.1819
Onchocerca volvulus Histone deacetylase 10 homolog 0.0013 0.0002 0.0032
Echinococcus granulosus Niemann Pick C1 protein 0.0096 0.0113 0.2656
Trypanosoma brucei histone deacetylase 2 0.0013 0.0002 0.0005
Trypanosoma brucei histone deacetylase 1 0.0013 0.0002 0.0005
Echinococcus granulosus expressed conserved protein 0.009 0.0105 0.2473
Echinococcus granulosus histone deacetylase 6 0.0043 0.0042 0.0986
Toxoplasma gondii autophagy-related cysteine peptidase atg4, putative 0.0023 0.0015 0.3624
Trichomonas vaginalis RNA polymerase II ctd phosphatase, putative 0.0019 0.001 0.1641
Schistosoma mansoni chromosome transmission fidelity factor 0.0019 0.001 0.0529
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0023 0.0015 0.0211
Loa Loa (eye worm) hypothetical protein 0.0037 0.0033 0.0033
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0023 0.0015 0.0211
Entamoeba histolytica histone deacetylase, putative 0.0013 0.0002 0.0142
Onchocerca volvulus 0.0012 0 0.0004
Brugia malayi AMP-binding enzyme family protein 0.0023 0.0015 0.0015
Echinococcus granulosus histone deacetylase 6 0.0043 0.0042 0.0986
Entamoeba histolytica peptidase, C54 family 0.0023 0.0015 0.1198
Loa Loa (eye worm) hypothetical protein 0.0023 0.0015 0.0015
Toxoplasma gondii histone deacetylase HDAC3 0.0013 0.0002 0.043
Loa Loa (eye worm) hypothetical protein 0.0019 0.001 0.001
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0041 0.004 0.004
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0023 0.0015 1
Brugia malayi Niemann-Pick C1 protein precursor 0.0096 0.0113 0.0113
Echinococcus multilocularis expressed conserved protein 0.009 0.0105 0.1009
Echinococcus granulosus cysteine protease atg4b 0.0059 0.0063 0.1485
Giardia lamblia Replication factor C, subunit 1 0.0019 0.001 1
Trypanosoma brucei malonyl-CoA decarboxylase, mitochondrial precursor, putative 0.2943 0.392 1
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.0015 0.0211
Mycobacterium leprae PROBABLE DNA LIGASE [NAD DEPENDENT] LIGA (POLYDEOXYRIBONUCLEOTIDE SYNTHASE [NAD+]) 0.0019 0.001 0.6698
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0069 0.0077 0.3953
Echinococcus granulosus histone deacetylase 7 0.0043 0.0042 0.0986
Echinococcus multilocularis histone deacetylase 3 0.0013 0.0002 0.0017
Trypanosoma cruzi malonyl-CoA decarboxylase, mitochondrial precursor, putative 0.2943 0.392 1
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.001 0.1641
Trypanosoma cruzi AUT2/APG4/ATG4 cysteine peptidase, putative 0.0023 0.0015 0.0039
Echinococcus multilocularis Peptidase C54 0.0059 0.0063 0.0606
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0015 0.0005 0.0005
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0044 0.104
Entamoeba histolytica acyl-CoA synthetase, putative 0.0023 0.0015 0.122
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0012 0 0.0012
Trichomonas vaginalis histone deacetylase, putative 0.0013 0.0002 0.0285
Loa Loa (eye worm) acetylcholinesterase 1 0.0069 0.0077 0.0077
Echinococcus granulosus replication factor c subunit 1 0.0019 0.001 0.0244
Schistosoma mansoni hypothetical protein 0.0015 0.0005 0.0254
Echinococcus multilocularis Niemann Pick C1 protein 0.0096 0.0113 0.1084
Loa Loa (eye worm) hypothetical protein 0.0019 0.001 0.001
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.0013 0.0002 0.0285
Brugia malayi histone deacetylase 11 0.0013 0.0002 0.0002
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0048 0.0049 0.0049
Trichomonas vaginalis spcc417.12 protein, putative 0.0012 0 0.0037
Loa Loa (eye worm) hypothetical protein 0.749 1 1
Echinococcus multilocularis cysteine protease atg4b 0.0059 0.0063 0.0606
Trypanosoma cruzi histone deacetylase 1, putative 0.0013 0.0002 0.0005
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.0013 0.0002 0.0285
Echinococcus granulosus histone deacetylase 6 0.0049 0.0051 0.1193
Loa Loa (eye worm) hypothetical protein 0.0041 0.004 0.004
Plasmodium falciparum histone deacetylase 2 0.0043 0.0042 1
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0023 0.0015 0.0211
Onchocerca volvulus 0.0012 0 0.0004
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.0015 0.0039
Brugia malayi Histone deacetylase family protein 0.0043 0.0042 0.0042
Loa Loa (eye worm) hypothetical protein 0.0435 0.0566 0.0566
Echinococcus granulosus histone deacetylase 8 0.0013 0.0002 0.0042
Loa Loa (eye worm) hypothetical protein 0.0013 0.0002 0.0002
Echinococcus multilocularis histone deacetylase 0.0043 0.0042 0.0402
Loa Loa (eye worm) hypothetical protein 0.0019 0.001 0.001
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0012 0 0.0003
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0016 0.0006 0.0087
Loa Loa (eye worm) histone deacetylase 1 0.0013 0.0002 0.0002
Schistosoma mansoni hypothetical protein 0.0015 0.0005 0.0254
Entamoeba histolytica Activator 1 140 kDa subunit, putative 0.0019 0.001 0.0817
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.0015 0.0039
Loa Loa (eye worm) histone deacetylase 7A 0.0043 0.0042 0.0042
Leishmania major histone deacetylase, putative 0.0043 0.0042 0.0107
Leishmania major AUT2/APG4/ATG4 cysteine peptidase, putative 0.0059 0.0063 0.0161
Loa Loa (eye worm) hypothetical protein 0.0092 0.0107 0.0107
Schistosoma mansoni histone deacetylase 4 5 0.0043 0.0042 0.2143
Loa Loa (eye worm) hypothetical protein 0.0023 0.0015 0.0015
Schistosoma mansoni histone deacetylase 1 2 3 0.0013 0.0002 0.0092
Echinococcus granulosus ankyrin repeat protein 0.0158 0.0195 0.4603
Loa Loa (eye worm) hypothetical protein 0.0017 0.0008 0.0008
Onchocerca volvulus Phospholipase A2 homolog 0.0435 0.0566 1
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase 0.0059 0.0063 1
Onchocerca volvulus 0.0047 0.0047 0.0837
Schistosoma mansoni hypothetical protein 0.004 0.0038 0.1924
Trichomonas vaginalis histone deacetylase, putative 0.0013 0.0002 0.0285
Echinococcus multilocularis survival motor neuron protein 1 0.023 0.0292 0.2811
Loa Loa (eye worm) carboxylesterase 0.0069 0.0077 0.0077
Treponema pallidum DNA ligase (lig) 0.0019 0.001 0.5
Trypanosoma cruzi malonyl-CoA decarboxylase, mitochondrial precursor, putative 0.2943 0.392 1
Loa Loa (eye worm) hypothetical protein 0.0013 0.0002 0.0002
Loa Loa (eye worm) hypothetical protein 0.0096 0.0113 0.0113
Onchocerca volvulus 0.0018 0.0009 0.016
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0023 0.0015 0.0211
Brugia malayi Peptidase family C54 containing protein 0.0059 0.0063 0.0063
Chlamydia trachomatis DNA ligase 0.0019 0.001 1
Brugia malayi AMP-binding enzyme family protein 0.0023 0.0015 0.0015
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.0015 0.0211
Trypanosoma brucei BRCA1 C Terminus (BRCT) domain containing protein, putative 0.0019 0.001 0.0026
Trypanosoma cruzi AUT2/APG4/ATG4 cysteine peptidase, putative 0.0059 0.0063 0.0161
Schistosoma mansoni gliotactin 0.0012 0 0.0012
Toxoplasma gondii ATPase, AAA family protein 0.0019 0.001 0.2471
Brugia malayi AMP-binding enzyme family protein 0.0023 0.0015 0.0015
Echinococcus multilocularis Niemann Pick C1 protein 0.0137 0.0168 0.1613
Onchocerca volvulus 0.0048 0.0049 0.0865
Echinococcus granulosus histone deacetylase 1 0.0013 0.0002 0.0042
Schistosoma mansoni topbp1 0.0019 0.001 0.0529
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0012 0 0.0012
Loa Loa (eye worm) hypothetical protein 0.0017 0.0008 0.0008
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0017 0.0008 0.0105
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.001 0.1641
Schistosoma mansoni family C54 unassigned peptidase (C54 family) 0.0059 0.0063 0.3226
Brugia malayi topoisomerase 0.0019 0.001 0.001
Echinococcus granulosus transient receptor potential cation channel 0.0161 0.02 0.4704
Mycobacterium ulcerans carboxylesterase, LipT 0.0012 0 0.0003
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0015 0.0005 0.0048
Schistosoma mansoni patched 1 0.0041 0.004 0.2026
Schistosoma mansoni hypothetical protein 0.004 0.0038 0.1924
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0016 0.0006 0.0087
Echinococcus granulosus para nitrobenzyl esterase 0.0012 0 0.0005
Brugia malayi hypothetical protein 0.0019 0.001 0.001
Echinococcus granulosus Niemann Pick C1 protein 0.0137 0.0168 0.3952
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0045 0.0044 0.0044
Entamoeba histolytica peptidase, C54 family 0.0059 0.0063 0.4979
Echinococcus granulosus BC026374 protein S09 family 0.0012 0 0.0005
Toxoplasma gondii histone deacetylase HDAC4 0.0013 0.0002 0.043
Schistosoma mansoni transcription factor LCR-F1 0.0106 0.0127 0.648
Brugia malayi histone deacetylase 3 (HD3) 0.0013 0.0002 0.0002
Schistosoma mansoni histone deacetylase 0.0013 0.0002 0.0092
Trypanosoma cruzi BRCA1 C Terminus (BRCT) domain containing protein, putative 0.0019 0.001 0.0026
Echinococcus granulosus survival motor neuron protein 1 0.023 0.0292 0.6889
Trypanosoma cruzi hypothetical protein, conserved 0.0019 0.001 0.0026
Brugia malayi Histone deacetylase family protein 0.0043 0.0042 0.0042
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0044 0.2259
Trypanosoma cruzi histone deacetylase, putative 0.0043 0.0042 0.0107
Echinococcus multilocularis histone deacetylase 6 0.0043 0.0042 0.0402
Loa Loa (eye worm) hypothetical protein 0.003 0.0025 0.0025
Trypanosoma brucei histone deacetylase, putative 0.0043 0.0042 0.0107
Trichomonas vaginalis histone deacetylase, putative 0.0013 0.0002 0.0285
Trichomonas vaginalis RNA polymerase II ctd phosphatase, putative 0.0019 0.001 0.1641
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0023 0.0015 0.0211
Schistosoma mansoni DNA ligase IV 0.0019 0.001 0.0529
Trypanosoma cruzi FHA domain containing protein, putative 0.0019 0.001 0.0026
Toxoplasma gondii histone deacetylase HDAC1 0.0043 0.0042 1
Echinococcus multilocularis tumor protein p63 0.0329 0.0424 0.408
Toxoplasma gondii poly(ADP-ribose) polymerase catalytic domain-containing protein 0.0019 0.001 0.2471
Schistosoma mansoni histone deacetylase 0.0013 0.0002 0.0092
Trichomonas vaginalis replication factor C large subunit, putative 0.0019 0.001 0.1641
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0012 0 0.0003
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0044 0.104
Echinococcus multilocularis neuroligin 0.0012 0 0.0002
Plasmodium falciparum replication factor C subunit 1, putative 0.0019 0.001 0.2471
Trypanosoma cruzi histone deacetylase, putative 0.0043 0.0042 0.0107
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.0096 0.0113 0.8906
Trypanosoma cruzi histone deacetylase 1, putative 0.0013 0.0002 0.0005
Echinococcus granulosus family S9 non peptidase ue S09 family 0.0012 0 0.0005
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0016 0.0006 0.0087
Onchocerca volvulus 0.0012 0 0.0004
Echinococcus multilocularis carboxylesterase 5A 0.0069 0.0077 0.0742
Schistosoma mansoni histone deacetylase hda2 0.0049 0.0051 0.2592
Entamoeba histolytica hypothetical protein 0.0106 0.0127 1
Echinococcus granulosus tumor protein p63 0.0329 0.0424 1
Schistosoma mansoni neuroligin 3 (S09 family) 0.0012 0 0.0012
Schistosoma mansoni transient receptor potential cation channel subfamily A member 0.0158 0.0195 1
Loa Loa (eye worm) hypothetical protein 0.0017 0.0008 0.0008
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.0015 0.0039
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0048 0.0049 0.0049
Leishmania major malonyl-coa decarboxylase-like protein 0.2943 0.392 1
Entamoeba histolytica hypothetical protein 0.0106 0.0127 1
Entamoeba histolytica peptidase, C54 family 0.0023 0.0015 0.1198
Brugia malayi ATP dependent DNA ligase C terminal region family protein 0.0019 0.001 0.001
Trichomonas vaginalis histone deacetylase, putative 0.0013 0.0002 0.0285
Schistosoma mansoni topbp1 0.0019 0.001 0.0529
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0015 0.0005 0.0117
Echinococcus multilocularis histone deacetylase 6 0.0043 0.0042 0.0402
Echinococcus granulosus histone deacetylase 3 0.0013 0.0002 0.0042
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0023 0.0015 0.0211
Onchocerca volvulus 0.0023 0.0015 0.0273
Trichomonas vaginalis carboxylesterase domain containing protein, putative 0.0012 0 0.0037
Echinococcus multilocularis histone deacetylase 8 0.0013 0.0002 0.0017
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase 0.0059 0.0063 1
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase 0.0059 0.0063 1
Wolbachia endosymbiont of Brugia malayi malonyl-CoA decarboxylase 0.749 1 1
Schistosoma mansoni survival motor neuron protein 0.0047 0.0047 0.2425
Echinococcus multilocularis protein dispatched 1 0.0047 0.0047 0.0455
Schistosoma mansoni hypothetical protein 0.0033 0.0029 0.1465
Echinococcus multilocularis para nitrobenzyl esterase 0.0012 0 0.0002
Mycobacterium ulcerans short chain dehydrogenase 0.0558 0.0731 1
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0015 0.0005 0.0117
Echinococcus granulosus Peptidase C54 0.0059 0.0063 0.1485
Loa Loa (eye worm) histone deacetylase 0.0043 0.0042 0.0042
Mycobacterium ulcerans hypothetical protein 0.0023 0.0015 0.0211
Echinococcus granulosus GPCR family 2 0.0015 0.0005 0.0117
Schistosoma mansoni hypothetical protein 0.0047 0.0047 0.2425
Plasmodium vivax histone deacetylase, putative 0.0043 0.0042 1
Trichomonas vaginalis conserved hypothetical protein 0.0041 0.004 0.628
Loa Loa (eye worm) hypothetical protein 0.023 0.0292 0.0292
Schistosoma mansoni acetylcholinesterase 0.0012 0 0.0012
Loa Loa (eye worm) hypothetical protein 0.0019 0.001 0.001
Leishmania major histone deacetylase, putative 0.0013 0.0002 0.0005
Plasmodium falciparum acyl-CoA synthetase 0.0017 0.0008 0.1825
Brugia malayi DKFZp564C0469 protein 0.0019 0.001 0.001
Echinococcus multilocularis protein patched 0.0041 0.004 0.038
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.001 0.1641
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0789 0.104 1
Schistosoma mansoni autophagin-1 (C54 family) 0.0059 0.0063 0.3226
Brugia malayi Carboxylesterase family protein 0.0069 0.0077 0.0077
Entamoeba histolytica peptidase, C54 family 0.0023 0.0015 0.1198
Brugia malayi hypothetical protein 0.0019 0.001 0.001
Leishmania major histone deacetylase, putative 0.0043 0.0042 0.0107
Echinococcus multilocularis acetylcholinesterase 0.0069 0.0077 0.0742
Loa Loa (eye worm) hypothetical protein 0.0019 0.001 0.001
Trypanosoma brucei AUT2/APG4/ATG4 cysteine peptidase, putative 0.0059 0.0063 0.0161
Plasmodium vivax histone deacetylase 2, putative 0.0043 0.0042 1
Echinococcus multilocularis GPCR, family 2 0.0015 0.0005 0.0048
Echinococcus multilocularis histone deacetylase 1 0.0013 0.0002 0.0017
Schistosoma mansoni hypothetical protein 0.0106 0.0127 0.648
Schistosoma mansoni cellular tumor antigen P53 0.0048 0.0049 0.2506
Loa Loa (eye worm) hypothetical protein 0.0015 0.0005 0.0005
Loa Loa (eye worm) hypothetical protein 0.0069 0.0077 0.0077
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0106 0.0127 0.2982
Mycobacterium ulcerans NAD-dependent DNA ligase LigA 0.0019 0.001 0.0142
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.0013 0.0002 0.0285
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0045 0.0044 0.0044
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0106 0.0127 0.1217
Brugia malayi Histone deacetylase 1 0.0013 0.0002 0.0002
Trypanosoma brucei cysteine peptidase, Clan CA, family C54, putative 0.0023 0.0015 0.0039
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.001 0.1641
Entamoeba histolytica hypothetical protein 0.0019 0.001 0.0817
Brugia malayi Calcitonin receptor-like protein seb-1 0.0048 0.0049 0.0049
Trichomonas vaginalis histone deacetylase, putative 0.0013 0.0002 0.0285
Loa Loa (eye worm) hypothetical protein 0.0059 0.0063 0.0063
Brugia malayi Carboxylesterase family protein 0.0069 0.0077 0.0077
Echinococcus granulosus nibrin 0.0019 0.001 0.0244
Plasmodium falciparum histone deacetylase, putative 0.0043 0.0042 1
Loa Loa (eye worm) hypothetical protein 0.0023 0.0015 0.0015
Echinococcus multilocularis ankyrin repeat protein 0.0158 0.0195 0.1878
Onchocerca volvulus 0.0012 0 0.0004
Plasmodium vivax acyl-CoA synthetase, putative 0.0017 0.0008 0.1825
Brugia malayi hypothetical protein 0.0106 0.0127 0.0127
Mycobacterium tuberculosis Probable oxidoreductase 0.0558 0.0731 1

Activities

Activity type Activity value Assay description Source Reference
EC50 (functional) > 30 uM Agonist activity at LXRbeta LBD by HTRF cofactor peptide recruitment assay ChEMBL. 17416521
EC50 (functional) > 30 uM Agonist activity at LXRbeta LBD by HTRF cofactor peptide recruitment assay ChEMBL. 17416521

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.

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