Detailed information for compound 1064569

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 539.641 | Formula: C32H29NO5S
  • H donors: 0 H acceptors: 0 LogP: 6.85 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 2
  • SMILES: COc1cc(OC)cc(c1)c1c(C#Cc2cscc2)c2c(n1C)ccc(c2)c1cc(OC)c(c(c1)OC)OC
  • InChi: 1S/C32H29NO5S/c1-33-28-10-8-21(22-16-29(36-4)32(38-6)30(17-22)37-5)15-27(28)26(9-7-20-11-12-39-19-20)31(33)23-13-24(34-2)18-25(14-23)35-3/h8,10-19H,1-6H3
  • InChiKey: NIWBPJSMNAODAG-UHFFFAOYSA-N  


Substructure search Similarity search

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 GNAS complex locus Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Schistosoma mansoni GTP-binding protein alpha subunit gna GNAS complex locus 394 aa 450 aa 28.7 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.0224 0.0636 0.432
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0042 0.0049 0.0032
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0142 0.0371 0.0886
Echinococcus granulosus ubiquitin specific protease 41 0.0045 0.0059 0.0054
Toxoplasma gondii isocitrate dehydrogenase 0.0136 0.0351 0.3132
Schistosoma mansoni hypothetical protein 0.0386 0.1156 0.2973
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0386 0.1156 0.1122
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0136 0.0351 1
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0136 0.0351 1
Schistosoma mansoni hypothetical protein 0.0516 0.1573 0.4082
Echinococcus granulosus peptidase Clp S14 family 0.0224 0.0636 0.1589
Entamoeba histolytica hypothetical protein 0.0299 0.0876 0.2583
Echinococcus multilocularis peptidase Clp (S14 family) 0.0224 0.0636 0.1589
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0136 0.0351 1
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0073 0.0151 0.0113
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0073 0.0151 0.0113
Brugia malayi MH2 domain containing protein 0.0096 0.0222 0.0185
Mycobacterium ulcerans hypothetical protein 0.0073 0.0151 0.1152
Loa Loa (eye worm) hypothetical protein 0.122 0.3838 0.3814
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0136 0.0351 0.0832
Loa Loa (eye worm) hypothetical protein 0.0073 0.0151 0.0113
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0073 0.0151 0.1152
Mycobacterium ulcerans lipase LipD 0.0073 0.0151 0.1152
Brugia malayi hypothetical protein 0.0299 0.0876 0.0841
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0214 0.0602 0.1499
Loa Loa (eye worm) RNA binding protein 0.1208 0.3799 0.3775
Echinococcus granulosus geminin 0.0516 0.1573 0.4082
Echinococcus multilocularis muscleblind protein 1 0.0295 0.0863 0.2195
Trichomonas vaginalis penicillin-binding protein, putative 0.0073 0.0151 1
Loa Loa (eye worm) MH1 domain-containing protein 0.0096 0.0222 0.0185
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative 0.0045 0.0059 0.1668
Echinococcus multilocularis mothers against decapentaplegic 2 0.0096 0.0222 0.0489
Schistosoma mansoni hypothetical protein 0.0834 0.2596 0.6803
Mycobacterium tuberculosis Probable lipase LipD 0.0073 0.0151 0.0813
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0342 0.1015 1
Loa Loa (eye worm) nuclear factor I 0.0118 0.0295 0.0258
Trichomonas vaginalis D-aminoacylase, putative 0.0073 0.0151 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.122 0.3838 0.3814
Loa Loa (eye worm) hypothetical protein 0.0295 0.0863 0.0828
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0045 0.0059 0.1807
Loa Loa (eye worm) beta-lactamase 0.0073 0.0151 0.0113
Schistosoma mansoni tar DNA-binding protein 0.1208 0.3799 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0142 0.0371 0.0886
Echinococcus granulosus mothers against decapentaplegic 5 0.0214 0.0602 0.1499
Loa Loa (eye worm) MH1 domain-containing protein 0.0214 0.0602 0.0566
Trypanosoma brucei DNA polymerase IV, putative 0.0038 0.0038 0.1089
Leishmania major hypothetical protein, conserved 0.0103 0.0248 0.6694
Echinococcus granulosus mothers against decapentaplegic 2 0.0096 0.0222 0.0489
Trichomonas vaginalis D-aminoacylase, putative 0.0073 0.0151 1
Giardia lamblia DNA repair protein RAD52 0.1047 0.3283 1
Loa Loa (eye worm) hypothetical protein 0.0386 0.1156 0.1122
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0136 0.0351 0.0832
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0142 0.0371 0.0334
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0136 0.0351 0.0832
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0046 0.0064 0.0069
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0042 0.0049 0.0032
Schistosoma mansoni ap endonuclease 0.0042 0.0049 0.0028
Brugia malayi MH1 domain containing protein 0.0118 0.0295 0.0258
Brugia malayi isocitrate dehydrogenase 0.0136 0.0351 0.0314
Mycobacterium ulcerans esterase/lipase LipP 0.0073 0.0151 0.1152
Onchocerca volvulus 0.0149 0.0394 1
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0042 0.0049 0.0335
Schistosoma mansoni tar DNA-binding protein 0.1208 0.3799 1
Mycobacterium tuberculosis Probable lipase LipE 0.0073 0.0151 0.0813
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0142 0.0371 0.0886
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0042 0.0049 0.0335
Loa Loa (eye worm) transcription factor SMAD2 0.3136 1 1
Trichomonas vaginalis ap endonuclease, putative 0.0042 0.0049 0.0932
Loa Loa (eye worm) hypothetical protein 0.0073 0.0151 0.0113
Schistosoma mansoni hypothetical protein 0.0516 0.1573 0.4082
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0038 0.1089
Brugia malayi beta-lactamase 0.0073 0.0151 0.0113
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0038 0.1089
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 0.0045 0.0059 0.0054
Mycobacterium ulcerans beta-lactamase 0.0073 0.0151 0.1152
Loa Loa (eye worm) latrophilin receptor protein 2 0.0386 0.1156 0.1122
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0142 0.0371 0.0334
Brugia malayi beta-lactamase family protein 0.0073 0.0151 0.0113
Trypanosoma brucei unspecified product 0.0038 0.0038 0.1089
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0142 0.0371 0.0886
Echinococcus granulosus muscleblind protein 0.0295 0.0863 0.2195
Entamoeba histolytica hypothetical protein 0.0299 0.0876 0.2583
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0136 0.0351 0.3132
Echinococcus multilocularis geminin 0.0516 0.1573 0.4082
Echinococcus granulosus mothers against decapentaplegic 6 0.0096 0.0222 0.0489
Echinococcus multilocularis beta LACTamase domain containing family member 0.0073 0.0151 0.0299
Loa Loa (eye worm) isocitrate dehydrogenase 0.0136 0.0351 0.0314
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0342 0.1015 1
Trypanosoma brucei DNA polymerase IV, putative 0.0038 0.0038 0.1089
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0045 0.0059 0.0649
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0342 0.1015 0.2596
Trypanosoma brucei PAB1-binding protein , putative 0.0103 0.0248 0.7054
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0042 0.0049 0.0011
Loa Loa (eye worm) MH2 domain-containing protein 0.0214 0.0602 0.0566
Schistosoma mansoni tar DNA-binding protein 0.1208 0.3799 1
Brugia malayi Muscleblind-like protein 0.0295 0.0863 0.0828
Loa Loa (eye worm) hypothetical protein 0.0073 0.0151 0.0113
Mycobacterium tuberculosis Conserved protein 0.0073 0.0151 0.0813
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0342 0.1015 1
Loa Loa (eye worm) TAR-binding protein 0.1208 0.3799 0.3775
Entamoeba histolytica DNA repair and recombination protein RAD52, putative 0.1047 0.3283 1
Loa Loa (eye worm) hypothetical protein 0.0342 0.1015 0.098
Schistosoma mansoni Smad4 0.0096 0.0222 0.0489
Plasmodium falciparum ataxin-2 like protein, putative 0.0103 0.0248 0.2061
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0342 0.1015 1
Trypanosoma brucei hypothetical protein, conserved 0.0073 0.0151 0.4292
Loa Loa (eye worm) hypothetical protein 0.0118 0.0295 0.0258
Echinococcus granulosus Smad4 0.0214 0.0602 0.1499
Brugia malayi RNA recognition motif domain containing protein 0.1208 0.3799 0.3775
Toxoplasma gondii ABC1 family protein 0.0073 0.0151 0.1056
Trichomonas vaginalis ap endonuclease, putative 0.0042 0.0049 0.0932
Plasmodium falciparum ataxin-2 like protein, putative 0.0103 0.0248 0.2061
Echinococcus granulosus smad 0.0214 0.0602 0.1499
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0073 0.0151 0.0813
Onchocerca volvulus Mothers against decapentaplegic homolog 0.0096 0.0222 0.2931
Loa Loa (eye worm) hypothetical protein 0.0295 0.0863 0.0828
Brugia malayi MH1 domain containing protein 0.0118 0.0295 0.0258
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0073 0.0151 0.0299
Loa Loa (eye worm) hypothetical protein 0.0073 0.0151 0.0113
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0299 0.0876 0.2228
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0038 0.1089
Schistosoma mansoni smad 0.0096 0.0222 0.0489
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative 0.0045 0.0059 0.0649
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0386 0.1156 0.2973
Echinococcus granulosus TGF beta signal transducer SmadC 0.0214 0.0602 0.1499
Schistosoma mansoni ap endonuclease 0.0042 0.0049 0.0028
Echinococcus multilocularis GPCR, family 2 0.0386 0.1156 0.2973
Mycobacterium leprae ATP-dependent Clp protease proteolytic subunit 1 0.0118 0.0294 0.1656
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0038 0.1089
Mycobacterium tuberculosis Conserved protein 0.0073 0.0151 0.0813
Schistosoma mansoni Smad4 0.0214 0.0602 0.1499
Brugia malayi MH1 domain containing protein 0.0214 0.0602 0.0566
Brugia malayi hypothetical protein 0.0103 0.0248 0.021
Entamoeba histolytica hypothetical protein 0.0299 0.0876 0.2583
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0386 0.1156 0.2973
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0038 0.1089
Echinococcus multilocularis mothers against decapentaplegic 5 0.0214 0.0602 0.1499
Schistosoma mansoni smad1 5 8 and 0.0214 0.0602 0.1499
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0038 0.1089
Schistosoma mansoni smad 0.0214 0.0602 0.1499
Entamoeba histolytica ubiquitin carboxyl-terminal hydrolase domain containing protein 0.0045 0.0059 0.0063
Brugia malayi Calcitonin receptor-like protein seb-1 0.122 0.3838 0.3814
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0046 0.0064 0.0069
Brugia malayi Probable ClpP-like protease 0.0342 0.1015 0.098
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0468 0.1421 1
Brugia malayi Isocitrate dehydrogenase 0.0136 0.0351 0.0314
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0038 0.1089
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) 0.0045 0.0059 0.0054
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0073 0.0151 0.0299
Loa Loa (eye worm) MH2 domain-containing protein 0.0096 0.0222 0.0185
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.1208 0.3799 0.3775
Mycobacterium tuberculosis Probable hydrolase 0.0073 0.0151 0.0813
Schistosoma mansoni hypothetical protein 0.0386 0.1156 0.2973
Loa Loa (eye worm) pigment dispersing factor receptor c 0.122 0.3838 0.3814
Schistosoma mansoni tar DNA-binding protein 0.1208 0.3799 1
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0136 0.0351 1
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0118 0.0294 0.2538
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0342 0.1015 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0038 0.1089
Schistosoma mansoni Smad4 0.0096 0.0222 0.0489
Schistosoma mansoni tar DNA-binding protein 0.1208 0.3799 1
Echinococcus granulosus GPCR family 2 0.0386 0.1156 0.2973
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0299 0.0876 0.2228
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0042 0.0049 0.0028
Loa Loa (eye worm) hypothetical protein 0.0096 0.0222 0.0185
Schistosoma mansoni peptidase Clp (S14 family) 0.0342 0.1015 0.2596
Brugia malayi MH1 domain containing protein 0.0214 0.0602 0.0566
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0042 0.0049 0.0028
Loa Loa (eye worm) hypothetical protein 0.0149 0.0394 0.0357
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0804 0.25 0.6545
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0073 0.0151 0.0813
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0342 0.1015 1
Schistosoma mansoni hypothetical protein 0.0046 0.0064 0.0069
Schistosoma mansoni smad1 5 8 and 0.0214 0.0602 0.1499
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0042 0.0049 0.0107
Plasmodium vivax ataxin-2 like protein, putative 0.0103 0.0248 0.2061
Trypanosoma brucei DNA polymerase eta, putative 0.0038 0.0038 0.1089
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0038 0.1089
Brugia malayi mothers against decapentaplegic homolog 3 0.0096 0.0222 0.0185
Trypanosoma brucei DNA polymerase IV, putative 0.0038 0.0038 0.1089
Brugia malayi Latrophilin receptor protein 2 0.0386 0.1156 0.1122
Trichomonas vaginalis D-aminoacylase, putative 0.0073 0.0151 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0073 0.0151 1
Brugia malayi beta-lactamase family protein 0.0073 0.0151 0.0113
Schistosoma mansoni hypothetical protein 0.0386 0.1156 0.2973
Echinococcus multilocularis mothers against decapentaplegic 6 0.0096 0.0222 0.0489
Echinococcus multilocularis ubiquitin specific protease 41 0.0045 0.0059 0.0054
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0142 0.0371 0.0886
Toxoplasma gondii isocitrate dehydrogenase 0.0136 0.0351 0.3132
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0045 0.0059 0.1807
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0342 0.1015 0.5
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0386 0.1156 0.2973
Loa Loa (eye worm) hypothetical protein 0.0045 0.0059 0.002
Echinococcus multilocularis isocitrate dehydrogenase 0.0136 0.0351 0.0832
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) 0.0045 0.0059 0.0054
Brugia malayi MH2 domain containing protein 0.0214 0.0602 0.0566
Loa Loa (eye worm) Smad1 0.0214 0.0602 0.0566
Entamoeba histolytica hypothetical protein 0.0298 0.0873 0.2573
Trypanosoma cruzi PAB1-binding protein , putative 0.0103 0.0248 0.6694
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0142 0.0371 0.0886
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0073 0.0151 0.0813
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 0.0045 0.0059 0.0063
Entamoeba histolytica hypothetical protein 0.0299 0.0876 0.2583
Mycobacterium tuberculosis Conserved protein 0.0073 0.0151 0.0813
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0136 0.0351 0.3132
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0042 0.0049 0.1388
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0136 0.0351 0.0832
Brugia malayi latrophilin 2 splice variant baaae 0.0834 0.2596 0.2568
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0045 0.0059 0.002
Trichomonas vaginalis esterase, putative 0.0073 0.0151 1
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 0.0045 0.0059 0.0054
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0038 0.1089
Loa Loa (eye worm) hypothetical protein 0.0103 0.0248 0.021
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0136 0.0351 1
Mycobacterium tuberculosis Probable esterase LipL 0.0073 0.0151 0.0813
Brugia malayi RNA binding protein 0.1208 0.3799 0.3775
Brugia malayi hypothetical protein 0.0149 0.0394 0.0357
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0136 0.0351 0.2263
Loa Loa (eye worm) hypothetical protein 0.0834 0.2596 0.2568
Entamoeba histolytica Rad52/22 family double-strand break repair protein, putative 0.0298 0.0873 0.2573
Schistosoma mansoni hypothetical protein 0.0386 0.1156 0.2973
Leishmania major hypothetical protein, conserved 0.0073 0.0151 0.3594
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0214 0.0602 0.1499
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 0.0045 0.0059 0.0054
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0342 0.1015 1
Loa Loa (eye worm) MH2 domain-containing protein 0.3136 1 1
Trypanosoma cruzi hypothetical protein, conserved 0.0073 0.0151 0.3594
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0118 0.0294 0.2538
Loa Loa (eye worm) hypothetical protein 0.0073 0.0151 0.0113
Schistosoma mansoni hypothetical protein 0.0299 0.0876 0.2228
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0342 0.1015 0.5
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.0224 0.0636 0.432
Brugia malayi TAR-binding protein 0.1208 0.3799 0.3775
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0042 0.0049 0.0076
Brugia malayi Smad1 0.0214 0.0602 0.0566
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0045 0.0059 0.0649
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0118 0.0294 0.2538
Schistosoma mansoni smad1 5 8 and 0.0214 0.0602 0.1499
Brugia malayi hypothetical protein 0.0067 0.013 0.0092
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0136 0.0351 0.0832
Echinococcus multilocularis Smad4 0.0214 0.0602 0.1499
Brugia malayi exodeoxyribonuclease III family protein 0.0042 0.0049 0.0011
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0142 0.0371 0.0886
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.0224 0.0636 0.5615
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0136 0.0351 0.0832
Loa Loa (eye worm) hypothetical protein 0.0073 0.0151 0.0113
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0342 0.1015 1
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0342 0.1015 0.2596
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 0.0045 0.0059 0.0054
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0042 0.0049 0.0335
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0386 0.1156 0.2973
Trichomonas vaginalis conserved hypothetical protein 0.0045 0.0059 0.1807
Schistosoma mansoni transcription factor LCR-F1 0.0299 0.0876 0.2228
Echinococcus multilocularis muscleblind protein 0.0295 0.0863 0.2195
Echinococcus multilocularis smad 0.0214 0.0602 0.1499
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0342 0.1015 1
Echinococcus granulosus tar DNA binding protein 0.1208 0.3799 1
Echinococcus granulosus beta LACTamase domain containing family member 0.0073 0.0151 0.0299
Toxoplasma gondii LsmAD domain-containing protein 0.0103 0.0248 0.2061
Trypanosoma cruzi PAB1-binding protein , putative 0.0103 0.0248 0.6694
Echinococcus multilocularis tar DNA binding protein 0.1208 0.3799 1
Brugia malayi MH2 domain containing protein 0.0214 0.0602 0.0566
Trypanosoma cruzi hypothetical protein, conserved 0.0073 0.0151 0.3594
Toxoplasma gondii hypothetical protein 0.0118 0.0294 0.2538
Plasmodium vivax hypothetical protein, conserved 0.0073 0.0151 0.1056

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 1.5849 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) 39.8107 uM PubChem BioAssay. Inhibitors of Secretory Acid Sphingomyelinase (S-ASM): qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 50.1187 uM PubChem BioAssay. qHTS Assay to Find Inhibitors of Pin1. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 89.1251 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.
 
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.

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