Detailed information for compound 1650580

Basic information

Technical information
  • TDR Targets ID: 1650580
  • Name: 2-[(7-acetyl-2,3-dihydro-1H-inden-5-yl)methyl ]-3,5,6,7-tetrahydro-2H-s-indacen-1-one
  • MW: 344.446 | Formula: C24H24O2
  • H donors: 0 H acceptors: 2 LogP: 5.01 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C1C(Cc2cc3CCCc3c(c2)C(=O)C)Cc2c1cc1CCCc1c2
  • InChi: 1S/C24H24O2/c1-14(25)22-10-15(8-18-6-3-7-21(18)22)9-20-12-19-11-16-4-2-5-17(16)13-23(19)24(20)26/h8,10-11,13,20H,2-7,9,12H2,1H3
  • InChiKey: XWTNIBVQFQJNHH-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-[(7-acetylindan-5-yl)methyl]-3,5,6,7-tetrahydro-2H-s-indacen-1-one
  • 2-[(7-acetyl-5-indanyl)methyl]-3,5,6,7-tetrahydro-2H-s-indacen-1-one
  • 2-[(7-ethanoyl-2,3-dihydro-1H-inden-5-yl)methyl]-3,5,6,7-tetrahydro-2H-s-indacen-1-one
  • NSC670335
  • NCI60_024747
  • 2-((7-Acetyl-2,3-dihydro-1H-inden-5-yl)methyl)-3,5,6,7-tetrahydro-s-indacen-1(2H)-one
  • AIDS-145521
  • AIDS145521

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
Leishmania major prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative 0.0036 0.051 0.448
Plasmodium falciparum proline--tRNA ligase 0.0036 0.051 0.051
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0102 0.2094 0.54
Onchocerca volvulus 0.004 0.0619 1
Plasmodium falciparum lysine--tRNA ligase 0.0023 0.0201 0.0201
Leishmania major cytochrome p450-like protein 0.0021 0.016 0.1406
Echinococcus granulosus glutamyl tRNA synthetase cytoplasmic 0.0031 0.0388 0.1002
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0102 0.2094 0.54
Schistosoma mansoni hypothetical protein 0.0021 0.016 0.0412
Schistosoma mansoni glucose transport protein 0.0102 0.2094 0.54
Brugia malayi hypothetical protein 0.004 0.0619 0.1701
Schistosoma mansoni rab6-interacting 0.004 0.0619 0.1595
Trypanosoma brucei THT1 - hexose transporter, putative 0.0032 0.0413 0.8107
Trichomonas vaginalis glucose transporter, putative 0.0032 0.0413 0.1973
Trypanosoma brucei glucose transporter 1E 0.0032 0.0413 0.8107
Trypanosoma brucei glucose transporter, putative 0.0032 0.0413 0.8107
Trichomonas vaginalis conserved hypothetical protein 0.0032 0.0413 0.1973
Mycobacterium tuberculosis Lysyl-tRNA synthetase 1 LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase) 0.0019 0.0119 0.1049
Trypanosoma brucei glucose transporter, putative 0.0032 0.0413 0.8107
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0062 0.1137 1
Brugia malayi hypothetical protein 0.0166 0.3636 1
Brugia malayi Cytochrome P450 family protein 0.003 0.0374 0.1027
Schistosoma mansoni cytochrome P450 0.0021 0.016 0.0412
Loa Loa (eye worm) cytochrome P450 0.0021 0.016 0.044
Loa Loa (eye worm) hypothetical protein 0.0025 0.0251 0.0691
Trypanosoma cruzi hexose transporter, putative 0.0032 0.0413 0.8107
Leishmania major glucose transporter, lmgt2 0.0032 0.0413 0.3632
Trypanosoma brucei THT1 - hexose transporter, putative 0.0032 0.0413 0.8107
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0058 0.1056 0.9281
Plasmodium falciparum calcium-dependent protein kinase 1 0.0031 0.0404 0.0404
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0102 0.2094 0.54
Schistosoma mansoni glucose transport protein 0.0102 0.2094 0.54
Plasmodium vivax calcium-dependent protein kinase, putative 0.0031 0.0404 0.0404
Brugia malayi Cytochrome P450 family protein 0.0021 0.016 0.044
Trypanosoma brucei glucose transporter, putative 0.0032 0.0413 0.8107
Loa Loa (eye worm) doublecortin family protein 0.004 0.0619 0.1701
Schistosoma mansoni lysyl-tRNA synthetase 0.0023 0.0201 0.0519
Plasmodium falciparum LCCL domain-containing protein 0.004 0.0619 0.0619
Mycobacterium ulcerans cytochrome P450 108B4 Cyp108B4 0.0021 0.016 0.1406
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0031 0.0404 0.1041
Loa Loa (eye worm) calcium/calmodulin-dependent protein kinase ID 0.0031 0.0404 0.111
Trichomonas vaginalis conserved hypothetical protein 0.0102 0.2094 1
Trypanosoma brucei glucose transporter, putative 0.0032 0.0413 0.8107
Mycobacterium ulcerans cytochrome P450 189A7 Cyp189A7 0.0021 0.016 0.1406
Leishmania major cytochrome p450-like protein 0.0021 0.016 0.1406
Brugia malayi Bifunctional aminoacyl-tRNA synthetase 0.0031 0.0388 0.1068
Mycobacterium tuberculosis Probable cytochrome P450 141 Cyp141 0.0021 0.016 0.1406
Plasmodium falciparum calcium-dependent protein kinase 4 0.0031 0.0404 0.0404
Schistosoma mansoni polycystin 1-related 0.004 0.0619 0.1595
Schistosoma mansoni lipoxygenase 0.0104 0.2148 0.5538
Schistosoma mansoni hypothetical protein 0.004 0.0619 0.1595
Plasmodium vivax multidomain scavenger receptor, putative 0.004 0.0619 0.0619
Mycobacterium ulcerans aldehyde dehydrogenase 0.0062 0.1137 1
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0054 0.0962 0.2645
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0058 0.1056 0.9281
Plasmodium falciparum protein kinase 7 0.0287 0.6542 0.6542
Loa Loa (eye worm) hypothetical protein 0.0166 0.3636 1
Echinococcus granulosus cytochrome P450 2K1 0.0021 0.016 0.0412
Mycobacterium tuberculosis Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM) 0.0021 0.016 0.1406
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0062 0.1137 1
Trypanosoma cruzi hexose transporter, putative 0.0017 0.007 0.1383
Brugia malayi lysyl-tRNA synthetase 0.0023 0.0201 0.0554
Toxoplasma gondii cell-cycle-associated protein kinase MAPK, putative 0.0164 0.3595 0.5495
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0102 0.2094 0.54
Brugia malayi hypothetical protein 0.004 0.0619 0.1701
Schistosoma mansoni aldehyde dehydrogenase 0.0062 0.1137 0.2933
Trypanosoma cruzi STE group serine/threonine-protein kinase, putative 0.0015 0.0012 0.0238
Mycobacterium tuberculosis Possible cytochrome P450 135A1 Cyp135A1 0.0021 0.016 0.1406
Echinococcus multilocularis General substrate transporter 0.0087 0.1752 0.4517
Trichomonas vaginalis prolyl-tRNA synthetase, putative 0.0031 0.0388 0.1855
Trypanosoma brucei lysyl-tRNA synthetase, putative 0.0023 0.0201 0.395
Trypanosoma cruzi STE group serine/threonine-protein kinase, putative 0.0015 0.0012 0.0238
Brugia malayi hypoxia-induced factor 1 0.0153 0.3327 0.9152
Trichomonas vaginalis sugar transporter, putative 0.0032 0.0413 0.1973
Echinococcus multilocularis lipoxygenase domain containing protein 0.004 0.0619 0.1595
Mycobacterium ulcerans cytochrome P450 187A4 Cyp187A4 0.0021 0.016 0.1406
Echinococcus multilocularis Polycystic kidney disease protein 0.004 0.0619 0.1595
Mycobacterium ulcerans putative regulatory protein 0.0037 0.0535 0.4703
Schistosoma mansoni glucose transport protein 0.0102 0.2094 0.54
Schistosoma mansoni glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs) 0.0031 0.0388 0.1002
Mycobacterium ulcerans cytochrome P450 187A5 Cyp187A5 0.0021 0.016 0.1406
Mycobacterium tuberculosis Probable cytochrome P450 monooxygenase 142 Cyp142 0.0021 0.016 0.1406
Trypanosoma brucei calcium/calmodulin-dependent protein kinase, putative 0.0031 0.0404 0.7919
Mycobacterium tuberculosis Probable cytochrome P450 132 Cyp132 0.0021 0.016 0.1406
Mycobacterium leprae Probable prolyl tRNA synthetase ProS 0.0031 0.0388 1
Mycobacterium ulcerans lysyl-tRNA synthetase 0.0023 0.0201 0.177
Trypanosoma brucei glucose transporter, putative 0.0032 0.0413 0.8107
Leishmania major protein kinase, putative 0.0015 0.0012 0.0107
Trypanosoma brucei glucose transporter, putative 0.0032 0.0413 0.8107
Echinococcus granulosus lysyl tRNA synthetase 0.0023 0.0201 0.0519
Mycobacterium tuberculosis Probable cytochrome P450 125 Cyp125 0.0021 0.016 0.1406
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0062 0.1137 0.2933
Trypanosoma cruzi cytochrome P450, putative 0.003 0.0374 0.733
Mycobacterium ulcerans cytochrome P450 191A3 Cyp191A3 0.0021 0.016 0.1406
Brugia malayi bifunctional aminoacyl-tRNA synthetase 0.0031 0.0388 0.1068
Schistosoma mansoni rab6-interacting 0.004 0.0619 0.1595
Mycobacterium tuberculosis Lysyl-tRNA synthetase 2 LysX 0.0019 0.0119 0.1049
Mycobacterium tuberculosis Probable cytochrome P450 124 Cyp124 0.0021 0.016 0.1406
Trypanosoma brucei glucose transporter, putative 0.0032 0.0413 0.8107
Mycobacterium ulcerans cytochrome P450 142A3 Cyp142A3 0.0021 0.016 0.1406
Giardia lamblia Prolyl-tRNA synthetase 0.0031 0.0388 1
Entamoeba histolytica prolyl-tRNA synthetase, putative 0.0031 0.0388 0.9253
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0031 0.0404 0.1041
Trichomonas vaginalis sugar transporter, putative 0.0032 0.0413 0.1973
Trypanosoma brucei THT1 - hexose transporter, putative 0.0032 0.0413 0.8107
Echinococcus granulosus calcium dependent protein kinase 0.0029 0.0357 0.0922
Loa Loa (eye worm) hypothetical protein 0.0031 0.0404 0.111
Leishmania major glucose transporter, lmgt1 0.0032 0.0413 0.3632
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0058 0.1056 0.2722
Trypanosoma cruzi hexose transporter, putative 0.0032 0.0413 0.8107
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0058 0.1056 0.9281
Echinococcus multilocularis lysyl tRNA synthetase 0.0023 0.0201 0.0519
Plasmodium falciparum hexose transporter 0.0102 0.2094 0.2094
Toxoplasma gondii aldehyde dehydrogenase 0.0062 0.1137 0.1739
Brugia malayi bHLH-PAS transcription factor 0.0037 0.0535 0.1472
Mycobacterium ulcerans cytochrome P450 143A3 Cyp143A3 0.0021 0.016 0.1406
Entamoeba histolytica protein kinase, putative 0.0031 0.0404 1
Leishmania major protein kinase, putative 0.0031 0.0404 0.3548
Trypanosoma cruzi STE/STE11 serine/threonine-protein kinase, putative 0.0015 0.0012 0.0238
Plasmodium vivax calcium-dependent protein kinase 3, putative 0.0031 0.0404 0.0404
Schistosoma mansoni protein kinase 0.0031 0.0404 0.1041
Trypanosoma brucei Lanosterol 14-alpha demethylase 0.0021 0.016 0.3139
Trichomonas vaginalis lysyl-tRNA synthetase, putative 0.002 0.0134 0.0641
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0058 0.1056 0.9281
Mycobacterium ulcerans cytochrome P450 140A5 Cyp140A5 0.0021 0.016 0.1406
Loa Loa (eye worm) CYP4Cod1 0.003 0.0374 0.1027
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 1 0.0031 0.0404 0.1041
Mycobacterium ulcerans cytochrome P450 51B1 Cyp51B1 0.0021 0.016 0.1406
Mycobacterium tuberculosis Probable cytochrome P450 137 Cyp137 0.0021 0.016 0.1406
Trypanosoma cruzi cytochrome p450-like protein, putative 0.0021 0.016 0.3139
Trypanosoma brucei cytochrome P450, putative 0.003 0.0374 0.733
Schistosoma mansoni single-minded 0.0049 0.0843 0.2174
Loa Loa (eye worm) cytochrome P450 family protein 0.0077 0.1515 0.4167
Mycobacterium tuberculosis Probable cytochrome P450 123 Cyp123 0.0021 0.016 0.1406
Leishmania major protein kinase, putative 0.0015 0.0012 0.0107
Echinococcus multilocularis glutamyl tRNA synthetase cytoplasmic 0.0031 0.0388 0.1002
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0031 0.0404 0.1041
Onchocerca volvulus 0.004 0.0619 1
Giardia lamblia Lysyl-tRNA synthetase 0.0023 0.0201 0.5182
Echinococcus multilocularis lipoxygenase domain containing protein 0.004 0.0619 0.1595
Trichomonas vaginalis glucose transporter, putative 0.0032 0.0413 0.1973
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0021 0.016 0.3139
Schistosoma mansoni lysyl-tRNA synthetase 0.0023 0.0201 0.0519
Echinococcus multilocularis 0.0021 0.016 0.0412
Schistosoma mansoni aldehyde dehydrogenase 0.0062 0.1137 0.2933
Trichomonas vaginalis sugar transporter, putative 0.0032 0.0413 0.1973
Mycobacterium ulcerans cytochrome P450 123A3 Cyp123A3 0.0021 0.016 0.1406
Plasmodium falciparum calcium-dependent protein kinase 5 0.0031 0.0404 0.0404
Plasmodium vivax calcium-dependent protein kinase 4, putative 0.0031 0.0404 0.0404
Mycobacterium tuberculosis Possible cytochrome P450 135B1 Cyp135B1 0.0021 0.016 0.1406
Echinococcus granulosus General substrate transporter 0.0087 0.1752 0.4517
Wolbachia endosymbiont of Brugia malayi major facilitator superfamily permease 0.0014 0 0.5
Trypanosoma brucei bifunctional aminoacyl-tRNA synthetase, putative 0.0036 0.051 1
Leishmania major glucose transporter/membrane transporter D2, putative 0.0032 0.0413 0.3632
Loa Loa (eye worm) CAMK/CAMK2 protein kinase 0.0031 0.0404 0.111
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0062 0.1137 0.2933
Entamoeba histolytica protein kinase, putative 0.0031 0.0404 1
Echinococcus granulosus lipoxygenase domain containing protein 0.004 0.0619 0.1595
Brugia malayi Cytochrome P450 family protein 0.0077 0.1515 0.4167
Toxoplasma gondii calcium-dependent protein kinase CDPK2A 0.0031 0.0404 0.0617
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0102 0.2094 0.54
Loa Loa (eye worm) hypothetical protein 0.004 0.0619 0.1701
Mycobacterium tuberculosis Cytochrome P450 121 Cyp121 0.0021 0.016 0.1406
Loa Loa (eye worm) cytochrome P450 family protein 0.003 0.0374 0.1027
Schistosoma mansoni loxhd1 0.004 0.0619 0.1595
Mycobacterium ulcerans cytochrome P450 126A3 Cyp126A3 0.0021 0.016 0.1406
Trichomonas vaginalis CAMK family protein kinase 0.0031 0.0404 0.1927
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 0.0021 0.016 0.1406
Onchocerca volvulus 0.0037 0.0535 0.8649
Mycobacterium ulcerans aldehyde dehydrogenase 0.0062 0.1137 1
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0058 0.1056 0.2722
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0176 0.3878 1
Loa Loa (eye worm) hypothetical protein 0.004 0.0619 0.1701
Trypanosoma cruzi cytochrome P450, putative 0.003 0.0374 0.733
Toxoplasma gondii lysine-tRNA ligase 0.0023 0.0201 0.0308
Toxoplasma gondii calcium-dependent protein kinase CDPK2B 0.0031 0.0404 0.0617
Brugia malayi cytochrome P450 0.0021 0.016 0.044
Mycobacterium ulcerans aldehyde dehydrogenase 0.0062 0.1137 1
Echinococcus multilocularis transfer RNA-Lys 0.0037 0.0535 0.138
Toxoplasma gondii protein kinase, putative 0.0287 0.6542 1
Leishmania major lysyl-tRNA synthetase, putative 0.0023 0.0201 0.177
Trypanosoma brucei glucose transporter 2A 0.0032 0.0413 0.8107
Schistosoma mansoni lipoxygenase 0.0176 0.3878 1
Echinococcus multilocularis solute carrier family 2, facilitated glucose 0.0102 0.2094 0.54
Echinococcus granulosus Polycystic kidney disease protein 0.004 0.0619 0.1595
Plasmodium vivax mitogen-activated protein kinase 2, putative 0.0164 0.3595 0.3595
Loa Loa (eye worm) hypothetical protein 0.0023 0.0201 0.0554
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0102 0.2094 0.54
Schistosoma mansoni protein kinase 0.0031 0.0404 0.1041
Brugia malayi Calcium/calmodulin-dependent protein kinase type II alpha chain 0.0031 0.0404 0.111
Mycobacterium ulcerans cytochrome P450 188A3 Cyp188A3 0.0021 0.016 0.1406
Loa Loa (eye worm) hypothetical protein 0.0031 0.0388 0.1068
Brugia malayi Cam kinase protein 1 0.0031 0.0404 0.111
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0031 0.0404 0.1041
Toxoplasma gondii cytochrome p450 superfamily protein 0.0021 0.016 0.0244
Mycobacterium ulcerans cytochrome P450 143A4 Cyp143A4 0.0021 0.016 0.1406
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0102 0.2094 0.54
Plasmodium falciparum calcium-dependent protein kinase 3 0.0031 0.0404 0.0404
Trypanosoma cruzi hexose transporter 0.0032 0.0413 0.8107
Trypanosoma cruzi prolyl-tRNA synthetase, putative 0.0036 0.051 1
Echinococcus multilocularis RUN 0.004 0.0619 0.1595
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0031 0.0404 0.1041
Trypanosoma cruzi lysyl-tRNA synthetase, putative 0.0023 0.0201 0.395
Leishmania major cytochrome p450-like protein 0.003 0.0374 0.3284
Mycobacterium tuberculosis Probable cytochrome P450 128 Cyp128 0.0021 0.016 0.1406
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0058 0.1056 0.2904
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.003 0.0374 0.3284
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0058 0.1056 0.2722
Trichomonas vaginalis lysyl-tRNA synthetase, putative 0.0023 0.0201 0.0961
Mycobacterium ulcerans lysyl-tRNA synthetase 0.0023 0.0201 0.177
Toxoplasma gondii calcium-dependent protein kinase CDPK3 0.0031 0.0404 0.0617
Brugia malayi Doublecortin family protein 0.004 0.0619 0.1701
Mycobacterium ulcerans cytochrome P450 124A1, Cyp124A1 0.0021 0.016 0.1406
Trichomonas vaginalis conserved hypothetical protein 0.0032 0.0413 0.1973
Chlamydia trachomatis lysine--tRNA ligase 0.0023 0.0201 0.5
Loa Loa (eye worm) hypothetical protein 0.0031 0.0388 0.1068
Mycobacterium ulcerans cytochrome P450 144A4 Cyp144A4 0.0021 0.016 0.1406
Schistosoma mansoni glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs) 0.0031 0.0388 0.1002
Plasmodium vivax lysine--tRNA ligase, putative 0.0023 0.0201 0.0201
Echinococcus granulosus single minded 2 0.0037 0.0535 0.138
Mycobacterium leprae Possible lysyl-tRNA synthetase 2 LysX 0.0023 0.0201 0.3046
Trypanosoma cruzi prolyl-tRNA synthetase, putative 0.0036 0.051 1
Mycobacterium tuberculosis Probable cytochrome P450 139 Cyp139 0.0021 0.016 0.1406
Schistosoma mansoni hypothetical protein 0.0102 0.2094 0.54
Plasmodium falciparum calcium-dependent protein kinase 2 0.0031 0.0404 0.0404
Plasmodium vivax hexose transporter 0.0102 0.2094 0.2094
Mycobacterium tuberculosis Probable cytochrome P450 144 Cyp144 0.0021 0.016 0.1406
Trypanosoma brucei glucose transporter, putative 0.0032 0.0413 0.8107
Leishmania major prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative 0.0036 0.051 0.448
Plasmodium vivax proline--tRNA ligase, putative 0.0036 0.051 0.051
Leishmania major glucose transporter, lmgt3 0.0032 0.0413 0.3632
Brugia malayi Cytochrome P450 family protein 0.003 0.0374 0.1027
Echinococcus granulosus RUN 0.004 0.0619 0.1595
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0031 0.0404 0.1041
Schistosoma mansoni aryl hydrocarbon receptor 0.0049 0.0843 0.2174
Mycobacterium ulcerans cytochrome P450 150A6 Cyp150A6 0.0021 0.016 0.1406
Echinococcus granulosus lipoxygenase domain containing protein 0.004 0.0619 0.1595
Toxoplasma gondii prolyl-tRNA synthetase (ProRS) 0.0036 0.051 0.0779
Loa Loa (eye worm) sugar transporter 0.0102 0.2094 0.576
Echinococcus multilocularis calcium dependent protein kinase 0.0029 0.0357 0.0922
Leishmania major lanosterol 14-alpha-demethylase, putative 0.0021 0.016 0.1406
Mycobacterium tuberculosis Possible cytochrome P450 126 Cyp126 0.0021 0.016 0.1406
Mycobacterium ulcerans cytochrome P450 105Q4 Cyp105Q4 0.0021 0.016 0.1406
Mycobacterium tuberculosis Probable cytochrome P450 138 Cyp138 0.0021 0.016 0.1406
Plasmodium vivax calcium-dependent protein kinase 1, putative 0.0031 0.0404 0.0404
Schistosoma mansoni protein kinase 0.0031 0.0404 0.1041
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0176 0.3878 1
Mycobacterium tuberculosis Probable cytochrome P450 130 Cyp130 0.0021 0.016 0.1406
Schistosoma mansoni serine/threonine protein kinase 0.0031 0.0404 0.1041
Plasmodium falciparum mitogen-activated protein kinase 2 0.0164 0.3595 0.3595
Mycobacterium ulcerans cytochrome P450 136A2 Cyp136A2 0.0021 0.016 0.1406
Mycobacterium leprae putative cytochrome p450 0.0021 0.016 0.1511
Trypanosoma cruzi STE/STE11 serine/threonine-protein kinase, putative 0.0015 0.0012 0.0238
Mycobacterium ulcerans cytochrome P450 125A7 Cyp125A7 0.0021 0.016 0.1406
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0031 0.0404 0.1041
Trypanosoma cruzi hexose transporter, putative 0.0032 0.0413 0.8107
Loa Loa (eye worm) hypoxia-induced factor 1 0.0153 0.3327 0.9152
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0021 0.016 0.3139
Mycobacterium ulcerans cytochrome p450 150 cyp150 0.0021 0.016 0.1406
Plasmodium vivax CDK-related protein kinase 6, putative 0.0431 1 1
Loa Loa (eye worm) cytochrome P450 family protein 0.003 0.0374 0.1027
Mycobacterium tuberculosis Probable cytochrome P450 140 Cyp140 0.0021 0.016 0.1406
Mycobacterium leprae Conserved hypothetical protein 0.0021 0.016 0.1511
Brugia malayi Sugar transporter family protein 0.0102 0.2094 0.576
Toxoplasma gondii facilitative glucose transporter GT1 0.0102 0.2094 0.3201
Brugia malayi PAS domain containing protein 0.0049 0.0843 0.2319
Mycobacterium tuberculosis Probable cytochrome P450 143 Cyp143 0.0021 0.016 0.1406

Activities

Activity type Activity value Assay description Source Reference
GI50 (functional) -5.063 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HL-60(TB) Leukemia cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.855 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SK-MEL-5 Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.823 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the NCI-H23 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.482 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MALME-3M Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.477 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MDA-N Breast cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.324 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SN12C Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.305 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the UO-31 Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.152 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SF-539 Central Nervous System cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.033 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the ACHN Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the DU-145 Prostate cell line. (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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