Detailed information for compound 1125520

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 386.486 | Formula: C25H26N2O2
  • H donors: 1 H acceptors: 1 LogP: 4.13 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C1[C@@H](NCC=CC[C@H](N1Cc1ccccc1)c1ccco1)Cc1ccccc1
  • InChi: 1S/C25H26N2O2/c28-25-22(18-20-10-3-1-4-11-20)26-16-8-7-14-23(24-15-9-17-29-24)27(25)19-21-12-5-2-6-13-21/h1-13,15,17,22-23,26H,14,16,18-19H2/t22-,23-/m0/s1
  • InChiKey: FEOKNKSGMNNDFL-GOTSBHOMSA-N  

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens karyopherin (importin) beta 1 No references
Homo sapiens snurportin 1 No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma japonicum Importin subunit beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma congolense importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania mexicana importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium berghei importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Candida albicans karyopherin-beta Get druggable targets OG5_127843 All targets in OG5_127843
Trichomonas vaginalis importin beta-1, putative Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania braziliensis importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma brucei importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus multilocularis importin subunit beta 1 Get druggable targets OG5_127843 All targets in OG5_127843
Trichomonas vaginalis Importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium yoelii importin beta-1 subunit Get druggable targets OG5_127843 All targets in OG5_127843
Toxoplasma gondii HEAT repeat-containing protein Get druggable targets OG5_127843 All targets in OG5_127843
Loa Loa (eye worm) nucleolar RNA-associated protein alpha Get druggable targets OG5_131808 All targets in OG5_131808
Cryptosporidium hominis importin-beta2 Get druggable targets OG5_127843 All targets in OG5_127843
Brugia malayi Importin beta-1 subunit Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma brucei importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium knowlesi importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania donovani importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium vivax importin-beta 2, putative Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma japonicum Importin subunit beta-1, putative Get druggable targets OG5_127843 All targets in OG5_127843
Cryptosporidium parvum importin/karyopherin Get druggable targets OG5_127843 All targets in OG5_127843
Babesia bovis importin beta subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma cruzi importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania infantum importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma brucei gambiense importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Theileria parva importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus multilocularis snurportin 1 Get druggable targets OG5_131808 All targets in OG5_131808
Schistosoma mansoni importin beta-1 Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium falciparum importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Brugia malayi RNA, U transporter 1 Get druggable targets OG5_131808 All targets in OG5_131808
Trichomonas vaginalis Importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Entamoeba histolytica hypothetical protein Get druggable targets OG5_127843 All targets in OG5_127843
Candida albicans karyopherin-beta Get druggable targets OG5_127843 All targets in OG5_127843
Neospora caninum hypothetical protein Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus granulosus snurportin 1 Get druggable targets OG5_131808 All targets in OG5_131808
Schistosoma japonicum Snurportin-1, putative Get druggable targets OG5_131808 All targets in OG5_131808
Leishmania major importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma mansoni hypothetical protein Get druggable targets OG5_131808 All targets in OG5_131808
Echinococcus granulosus importin subunit beta 1 Get druggable targets OG5_127843 All targets in OG5_127843

By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity

Obtained from network model

Ranking Plot


Putative Targets List


Species Potential target Raw Global Species
Echinococcus granulosus Protein patched homolog 1 0.0046 0.0025 0.0094
Plasmodium vivax acyl carrier protein, putative 0.0417 0.0502 0.3816
Onchocerca volvulus 0.7196 0.9208 0.9656
Mycobacterium tuberculosis Polyketide synthetase MbtC (polyketide synthase) 0.1404 0.177 0.2084
Brugia malayi Muscleblind-like protein 0.0106 0.0103 0.0103
Schistosoma mansoni gliotactin 0.0207 0.0232 0.1423
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0207 0.0232 0.1423
Mycobacterium ulcerans acyl-CoA synthetase 0.0425 0.0512 0.0366
Loa Loa (eye worm) fatty acid synthase 0.4075 0.52 0.5865
Schistosoma mansoni carbonic anhydrase 0.011 0.0107 0.0623
Schistosoma mansoni acyl carrier protein 0.0417 0.0502 0.3162
Echinococcus granulosus tachykinin peptides receptor 99D 0.0338 0.0401 0.2552
Trypanosoma brucei oxidoreductase, putative 0.0257 0.0295 0.2213
Echinococcus multilocularis mitochondrial trans 2 enoyl coenzyme A reductase 0.0257 0.0295 0.1864
Echinococcus multilocularis Niemann Pick C1 protein 0.0153 0.0163 0.0996
Brugia malayi Methyltransferase-like protein 4 0.1244 0.1564 0.1564
Echinococcus multilocularis muscleblind protein 0.0106 0.0103 0.0601
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0046 0.0025 0.0016
Echinococcus multilocularis protein dispatched 1 0.0053 0.0033 0.0149
Mycobacterium tuberculosis Conserved protein 0.1244 0.1564 0.1818
Loa Loa (eye worm) hypothetical protein 0.011 0.0107 0.0109
Echinococcus granulosus carboxylesterase 5A 0.1224 0.1538 1
Entamoeba histolytica NADP-dependent alcohol dehydrogenase, putative 0.0257 0.0295 0.5504
Loa Loa (eye worm) hypothetical protein 0.0257 0.0295 0.0322
Plasmodium falciparum malonyl CoA-acyl carrier protein transacylase 0.0261 0.0301 0.2255
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.1224 0.1538 0.9836
Echinococcus granulosus AMP dependent ligase 0.0418 0.0503 0.3223
Brugia malayi Beta-ketoacyl synthase, N-terminal domain containing protein 0.4115 0.525 0.525
Mycobacterium tuberculosis Probable zinc-type alcohol dehydrogenase AdhD (aldehyde reductase) 0.0257 0.0295 0.0173
Leishmania major beta-ketoacyl synthase family protein, putative,3-oxoacyl-acyl carrier protein synthase ii, putative 0.1037 0.1297 0.8293
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.0203 0.0227 0.1393
Mycobacterium leprae Polyketide synthase Pks13 0.6158 0.7874 1
Mycobacterium ulcerans NADP-dependent oxidoreductase 0.0257 0.0295 0.0083
Mycobacterium ulcerans Type I modular polyketide synthase 0.4115 0.525 0.6567
Schistosoma mansoni BC026374 protein (S09 family) 0.0207 0.0232 0.1423
Loa Loa (eye worm) hypothetical protein 0.0041 0.0019 0.0009
Mycobacterium ulcerans zinc-type alcohol dehydrogenase AdhD 0.0257 0.0295 0.0083
Mycobacterium tuberculosis Probable multifunctional mycocerosic acid synthase membrane-associated Mas 0.4371 0.558 0.7025
Mycobacterium tuberculosis P-hydroxybenzoyl-AMP ligase FadD22 0.0425 0.0512 0.0453
Mycobacterium tuberculosis Peptide synthetase MbtE (peptide synthase) 0.0425 0.0512 0.0453
Brugia malayi CHE-14 protein 0.0046 0.0025 0.0025
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0207 0.0232 0.009
Chlamydia trachomatis 3-oxoacyl-ACP synthase 0.1037 0.1297 1
Giardia lamblia Methyltransferase like 2 0.1244 0.1564 0.5
Trypanosoma cruzi NADP-dependent alcohol hydrogenase, putative 0.0257 0.0295 0.2264
Schistosoma mansoni hypothetical protein 0.0372 0.0443 0.2786
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0112 0.0109 0.0635
Toxoplasma gondii acyl transferase domain-containing protein 0.0261 0.0301 0.0521
Trichomonas vaginalis carboxylesterase domain containing protein, putative 0.0207 0.0232 0.1469
Plasmodium falciparum ataxin-2 like protein, putative 0.0041 0.0019 0.0062
Mycobacterium tuberculosis Possible dehydrogenase 0.0257 0.0295 0.0173
Loa Loa (eye worm) carboxylesterase 0.0207 0.0232 0.025
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSE 0.2716 0.3454 0.4168
Echinococcus multilocularis carbonic anhydrase II 0.0203 0.0227 0.1417
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsD 0.4115 0.525 0.6598
Brugia malayi Carboxylesterase family protein 0.1224 0.1538 0.1538
Mycobacterium ulcerans oxidoreductase 0.0257 0.0295 0.0083
Echinococcus multilocularis expressed conserved protein 0.0101 0.0095 0.0555
Mycobacterium ulcerans polyketide synthase MbtD 0.127 0.1597 0.1786
Schistosoma mansoni 3-oxoacyl-[ACP] synthase 0.1037 0.1297 0.8284
Mycobacterium ulcerans 3-oxoacyl-(acyl carrier protein) synthase II 0.1037 0.1297 0.1394
Mycobacterium tuberculosis Probable polyketide beta-ketoacyl synthase Pks4 0.0634 0.078 0.0801
Mycobacterium tuberculosis Polyketide synthetase MbtD (polyketide synthase) 0.127 0.1597 0.186
Trypanosoma cruzi nuclear receptor binding factor, putative 0.0257 0.0295 0.2264
Loa Loa (eye worm) hypothetical protein 0.0207 0.0232 0.025
Mycobacterium ulcerans polyketide synthase 0.4371 0.558 0.6998
Leishmania major hypothetical protein, conserved 0.0261 0.0301 0.1912
Trichomonas vaginalis spcc417.12 protein, putative 0.0207 0.0232 0.1469
Brugia malayi Putative carbonic anhydrase 5 precursor 0.0203 0.0227 0.0227
Echinococcus multilocularis carboxylesterase 5A 0.1224 0.1538 1
Brugia malayi ADP-specific Phosphofructokinase/Glucokinase conserved region family protein 0.0261 0.0301 0.0301
Schistosoma mansoni hypothetical protein 0.0044 0.0023 0.0079
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.011 0.0107 0.0107
Loa Loa (eye worm) hypothetical protein 0.0106 0.0103 0.0104
Plasmodium falciparum acyl carrier protein 0.0417 0.0502 0.3816
Echinococcus granulosus 3 oxoacyl acyl carrier protein synthase 0.1037 0.1297 0.8422
Echinococcus multilocularis carbonic anhydrase 0.011 0.0107 0.0633
Mycobacterium tuberculosis Probable NADPH quinone oxidoreductase FadB4 (NADPH:quinone reductase) (zeta-crystallin) 0.0257 0.0295 0.0173
Leishmania major carbonic anhydrase-like protein 0.0203 0.0227 0.144
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0112 0.0109 0.0646
Mycobacterium tuberculosis Possible dehydrogenase 0.0257 0.0295 0.0173
Loa Loa (eye worm) hypothetical protein 0.0257 0.0295 0.0322
Brugia malayi AMP-binding enzyme family protein 0.1271 0.1598 0.1598
Mycobacterium ulcerans zinc-containing alcohol dehydrogenase NAD-dependent AdhB 0.0257 0.0295 0.0083
Mycobacterium tuberculosis Probable polyketide beta-ketoacyl synthase Pks3 0.0634 0.078 0.0801
Entamoeba histolytica acyl-CoA synthetase, putative 0.0443 0.0535 1
Toxoplasma gondii hypothetical protein 0.011 0.0107 0.0174
Toxoplasma gondii acyl carrier protein ACP 0.0417 0.0502 0.0881
Mycobacterium tuberculosis S-nitrosomycothiol reductase MscR 0.0257 0.0295 0.0173
Mycobacterium tuberculosis Probable quinone reductase Qor (NADPH:quinone reductase) (zeta-crystallin homolog protein) 0.0257 0.0295 0.0173
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0338 0.0401 0.2552
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0207 0.0232 0.009
Plasmodium vivax ataxin-2 like protein, putative 0.0041 0.0019 0.0062
Mycobacterium ulcerans polyketide synthase MbtC 0.1037 0.1297 0.1394
Brugia malayi hypothetical protein 0.0041 0.0019 0.0019
Brugia malayi Phosphopantetheine attachment site family protein 0.0417 0.0502 0.0502
Echinococcus granulosus expressed conserved protein 0.0101 0.0095 0.0555
Loa Loa (eye worm) hypothetical protein 0.1224 0.1538 0.1727
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0035 0.0012 0.0012
Loa Loa (eye worm) hypothetical protein 0.0207 0.0232 0.025
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0112 0.0109 0.0111
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsA 0.3308 0.4214 0.5211
Mycobacterium tuberculosis Probable alcohol dehydrogenase AdhA 0.0257 0.0295 0.0173
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSA 0.4115 0.525 0.6538
Loa Loa (eye worm) carboxylesterase 0.1224 0.1538 0.1727
Echinococcus multilocularis protein patched 0.0046 0.0025 0.0094
Chlamydia trachomatis acyl carrier protein 0.0417 0.0502 0.2016
Mycobacterium ulcerans non-ribosomal peptide synthetase MbtF 0.0425 0.0512 0.0366
Brugia malayi AMP-binding enzyme family protein 0.3866 0.4932 0.4932
Leishmania major d-xylulose reductase, putative 0.0257 0.0295 0.1878
Toxoplasma gondii LsmAD domain-containing protein 0.0041 0.0019 0.0014
Trypanosoma cruzi PAB1-binding protein , putative 0.0041 0.0019 0.0127
Loa Loa (eye worm) hypothetical protein 0.0207 0.0232 0.025
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.011 0.0107 0.0107
Loa Loa (eye worm) hypothetical protein 0.0107 0.0104 0.0105
Schistosoma mansoni [ACP] S-malonyltransferase 0.0261 0.0301 0.1868
Trichomonas vaginalis conserved hypothetical protein 0.0046 0.0025 0.0146
Mycobacterium tuberculosis Probable NADP-dependent alcohol dehydrogenase AdhC 0.0257 0.0295 0.0173
Schistosoma mansoni hypothetical protein 0.0044 0.0023 0.0079
Echinococcus granulosus mitochondrial trans 2 enoyl coenzyme A reductase 0.0257 0.0295 0.1864
Echinococcus multilocularis neuroligin 0.0207 0.0232 0.1446
Brugia malayi oxidoreductase, zinc-binding dehydrogenase family protein 0.0257 0.0295 0.0295
Echinococcus granulosus acetylcholinesterase 0.1224 0.1538 1
Schistosoma mansoni methyltransferase-related 0.1244 0.1564 1
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.011 0.0107 0.0107
Leishmania major oxidoreductase, putative 0.0257 0.0295 0.1878
Loa Loa (eye worm) phosphopantetheine attachment site family protein 0.0417 0.0502 0.0555
Brugia malayi Carboxylesterase family protein 0.0207 0.0232 0.0232
Mycobacterium ulcerans zinc-dependent alcohol dehydrogenase AdhE2 0.0257 0.0295 0.0083
Loa Loa (eye worm) AMP-binding enzyme family protein 0.3866 0.4932 0.5562
Mycobacterium tuberculosis Polyketide synthase Pks13 0.6158 0.7874 1
Echinococcus granulosus carbonic anhydrase 0.011 0.0107 0.0633
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSD 0.4115 0.525 0.6538
Brugia malayi Carboxylesterase family protein 0.1224 0.1538 0.1538
Mycobacterium ulcerans oxidoreductase FadB5 0.0257 0.0295 0.0083
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.0203 0.0227 0.0245
Plasmodium falciparum carbonic anhydrase 0.011 0.0107 0.0752
Plasmodium falciparum 3-oxoacyl-acyl-carrier protein synthase I/II 0.1037 0.1297 1
Loa Loa (eye worm) hypothetical protein 0.0207 0.0232 0.025
Mycobacterium leprae Probable multifunctional mycocerosic acid synthase membrane associated enzyme Mas 0.4371 0.558 0.6973
Mycobacterium ulcerans short-chain dehydrogenase 0.0257 0.0295 0.0083
Mycobacterium ulcerans fatty-acid-CoA ligase FadD9 0.0418 0.0503 0.0355
Mycobacterium ulcerans Type I modular polyketide synthase 0.4115 0.525 0.6567
Mycobacterium ulcerans multifunctional mycocerosic acid synthase membrane-associated Mas 0.4371 0.558 0.6998
Echinococcus granulosus carbonic anhydrase 0.011 0.0107 0.0633
Trypanosoma cruzi NADP-dependent alcohol hydrogenase, putative 0.0257 0.0295 0.2264
Brugia malayi Calcitonin receptor-like protein seb-1 0.0035 0.0012 0.0012
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSB 0.3308 0.4214 0.5171
Trypanosoma brucei beta-ketoacyl-ACP synthase 0.1037 0.1297 1
Echinococcus multilocularis NADH dehydrogenase 0.0417 0.0502 0.3214
Trypanosoma cruzi oxidoreductase, putative 0.0257 0.0295 0.2264
Trypanosoma brucei PAB1-binding protein , putative 0.0041 0.0019 0.0062
Schistosoma mansoni [ACP] S-malonyltransferase 0.0261 0.0301 0.1868
Loa Loa (eye worm) hypothetical protein 0.0056 0.0038 0.0031
Mycobacterium tuberculosis Acyl carrier protein (ACP) MbtL 0.0417 0.0502 0.044
Schistosoma mansoni zinc binding dehydrogenase 0.0257 0.0295 0.1833
Loa Loa (eye worm) hypothetical protein 0.011 0.0107 0.0109
Echinococcus granulosus acyl carrier protein mitochondrial 0.0417 0.0502 0.3214
Echinococcus multilocularis muscleblind protein 1 0.0106 0.0103 0.0601
Schistosoma mansoni hypothetical protein 0.0205 0.0229 0.1404
Mycobacterium tuberculosis Probable fatty acid synthase Fas (fatty acid synthetase) 0.1297 0.1632 0.1906
Echinococcus granulosus BC026374 protein S09 family 0.0207 0.0232 0.1446
Schistosoma mansoni carbonic anhydrase-related 0.011 0.0107 0.0623
Mycobacterium ulcerans non-ribosomal peptide synthetase MbtE 0.0425 0.0512 0.0366
Brugia malayi Carboxylesterase family protein 0.0207 0.0232 0.0232
Toxoplasma gondii 3-oxoacyl-acyl-carrier protein synthase I/II, putative 0.1037 0.1297 0.231
Onchocerca volvulus Fatty acid synthase homolog 0.7445 0.9528 1
Loa Loa (eye worm) hypothetical protein 0.1224 0.1538 0.1727
Leishmania major hypothetical protein, conserved 0.0041 0.0019 0.0105
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsE 0.0634 0.078 0.0801
Onchocerca volvulus Acyl carrier protein, mitochondrial homolog 0.0417 0.0502 0.0291
Mycobacterium leprae PROBABLE FATTY ACID SYNTHASE FAS (FATTY ACID SYNTHETASE) 0.1297 0.1632 0.1764
Schistosoma mansoni patched 1 0.0046 0.0025 0.0093
Echinococcus granulosus para nitrobenzyl esterase 0.0207 0.0232 0.1446
Mycobacterium ulcerans quinone oxidoreductase 0.0257 0.0295 0.0083
Brugia malayi oxidoreductase, zinc-binding dehydrogenase family protein 0.0257 0.0295 0.0295
Mycobacterium tuberculosis Probable polyketide synthase Pks7 0.4371 0.558 0.7025
Mycobacterium tuberculosis Probable peptide synthetase Nrp (peptide synthase) 0.0425 0.0512 0.0453
Trypanosoma cruzi oxidoreductase, putative 0.0257 0.0295 0.2264
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.011 0.0107 0.0109
Onchocerca volvulus 0.0257 0.0295 0.0069
Mycobacterium tuberculosis Phenyloxazoline synthase MbtB (phenyloxazoline synthetase) 0.3866 0.4932 0.6185
Loa Loa (eye worm) acetylcholinesterase 1 0.1224 0.1538 0.1727
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0592 0.0726 0.5561
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0035 0.0012 0.0001
Echinococcus multilocularis carbonic anhydrase 0.011 0.0107 0.0633
Echinococcus multilocularis family S9 non peptidase ue (S09 family) 0.0207 0.0232 0.1446
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0203 0.0227 0.0227
Plasmodium vivax hypothetical protein, conserved 0.0592 0.0726 0.5561
Brugia malayi Niemann-Pick C1 protein precursor 0.0107 0.0104 0.0104
Brugia malayi Beta-ketoacyl synthase, N-terminal domain containing protein 0.1037 0.1297 0.1297
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsA 0.4115 0.525 0.6598
Mycobacterium tuberculosis Probable membrane bound polyketide synthase Pks6 0.6158 0.7874 1
Echinococcus multilocularis snurportin 1 0.0372 0.0443 0.2832
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0112 0.0109 0.0109
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.011 0.0107 0.0107
Loa Loa (eye worm) hypothetical protein 0.0207 0.0232 0.025
Onchocerca volvulus 0.0257 0.0295 0.0069
Wolbachia endosymbiont of Brugia malayi acyl carrier protein 0.0417 0.0502 0.2059
Plasmodium falciparum ataxin-2 like protein, putative 0.0041 0.0019 0.0062
Echinococcus multilocularis sterol regulatory element binding protein 0.0046 0.0025 0.0094
Loa Loa (eye worm) acyl carrier protein 0.0417 0.0502 0.0555
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0112 0.0109 0.0635
Brugia malayi acyl carrier protein, mitochondrial precursor, putative 0.0417 0.0502 0.0502
Trichomonas vaginalis conserved hypothetical protein 0.1244 0.1564 1
Loa Loa (eye worm) hypothetical protein 0.0634 0.078 0.0869
Echinococcus granulosus carbonic anhydrase II 0.0203 0.0227 0.1417
Echinococcus granulosus Niemann Pick C1 protein 0.0107 0.0104 0.0609
Echinococcus granulosus muscleblind protein 0.0106 0.0103 0.0601
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0112 0.0109 0.0646
Loa Loa (eye worm) hypothetical protein 0.0634 0.078 0.0869
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSC 0.4371 0.558 0.6973
Schistosoma mansoni hypothetical protein 0.011 0.0107 0.0623
Mycobacterium ulcerans zinc-containing alcohol dehydrogenase NAD dependent AdhB 0.0257 0.0295 0.0083
Mycobacterium ulcerans NADPH quinone oxidoreductase FadB4 0.0257 0.0295 0.0083
Echinococcus multilocularis Niemann Pick C1 protein 0.0107 0.0104 0.0609
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0112 0.0109 0.0646
Trichomonas vaginalis alcohol dehydrogenase, putative 0.0257 0.0295 0.1878
Loa Loa (eye worm) hypothetical protein 0.6924 0.8858 1
Echinococcus granulosus family S9 non peptidase ue S09 family 0.0207 0.0232 0.1446
Trypanosoma cruzi oxidoreductase, putative 0.0257 0.0295 0.2264
Schistosoma mansoni hypothetical protein 0.0417 0.0502 0.3162
Leishmania major zinc-binding dehydrogenase-like protein 0.0257 0.0295 0.1878
Echinococcus granulosus neuroligin 0.0207 0.0232 0.1446
Trypanosoma cruzi Acyl carrier protein, mitochondrial, putative 0.0417 0.0502 0.3857
Trypanosoma cruzi PAB1-binding protein , putative 0.0041 0.0019 0.0127
Mycobacterium tuberculosis Probable thioesterase TesA 0.3442 0.4386 0.5477
Loa Loa (eye worm) hypothetical protein 0.2299 0.2918 0.3286
Mycobacterium ulcerans NADP-dependent alcohol dehydrogenase AdhC 0.0257 0.0295 0.0083
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsE 0.2716 0.3454 0.4216
Echinococcus multilocularis 3 oxoacyl (acyl carrier protein) synthase 0.1037 0.1297 0.8422
Mycobacterium ulcerans dehydrogenase 0.0257 0.0295 0.0083
Schistosoma mansoni carbonic anhydrase-related 0.011 0.0107 0.0623
Mycobacterium ulcerans Zn-dependent alcohol dehydrogenase, AdhX 0.0257 0.0295 0.0083
Mycobacterium ulcerans hypothetical protein 0.0417 0.0502 0.0353
Mycobacterium tuberculosis Probable oxidoreductase 0.0257 0.0295 0.0173
Loa Loa (eye worm) hypothetical protein 0.0257 0.0295 0.0322
Toxoplasma gondii AMP-binding enzyme domain-containing protein 0.2088 0.2648 0.4734
Echinococcus multilocularis geminin 0.0205 0.0229 0.1428
Trypanosoma brucei carbonic anhydrase-like protein 0.0203 0.0227 0.1682
Onchocerca volvulus Putative alcohol dehydrogenase 0.0257 0.0295 0.0069
Mycobacterium tuberculosis Probable polyketide synthase Pks15 0.167 0.2111 0.2527
Trypanosoma cruzi NADP-dependent alcohol hydrogenase, putative 0.0257 0.0295 0.2264
Schistosoma mansoni acetylcholinesterase 0.0207 0.0232 0.1423
Brugia malayi Carboxylesterase family protein 0.0207 0.0232 0.0232
Echinococcus granulosus snurportin 1 0.0372 0.0443 0.2832
Echinococcus multilocularis BC026374 protein (S09 family) 0.0207 0.0232 0.1446
Mycobacterium ulcerans peptide synthetase Nrp (peptide synthase) 0.0425 0.0512 0.0366
Mycobacterium ulcerans non-ribosomal peptide synthetase 0.0418 0.0503 0.0355
Mycobacterium leprae Probable polyketide synthase Pks1 0.4371 0.558 0.6973
Mycobacterium leprae conserved hypothetical protein 0.0417 0.0502 0.0272
Trypanosoma cruzi acyl transferase-like protein 0.0261 0.0301 0.2305
Echinococcus granulosus sterol regulatory element binding protein 0.0046 0.0025 0.0094
Mycobacterium leprae PROBABLE POLYKETIDE BETA-KETOACYL SYNTHASE PKS4 0.0634 0.078 0.0639
Mycobacterium tuberculosis Probable acyl carrier protein AcpA (ACP) 0.0417 0.0502 0.044
Treponema pallidum acyl carrier protein 0.0417 0.0502 0.5
Echinococcus multilocularis AMP dependent ligase 0.0418 0.0503 0.3223
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsC 0.4371 0.558 0.6998
Mycobacterium ulcerans fatty acid synthase Fas 0.1297 0.1632 0.1833
Mycobacterium leprae Probable fatty-acid-CoA ligase FadD9 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0418 0.0503 0.0274
Loa Loa (eye worm) hypothetical protein 0.0261 0.0301 0.0328
Loa Loa (eye worm) alcohol dehydrogenase class III 0.0257 0.0295 0.0322
Echinococcus multilocularis Acyl carrier protein, mitochondrial 0.0417 0.0502 0.3214
Trichomonas vaginalis alcohol dehydrogenase, putative 0.0257 0.0295 0.1878
Mycobacterium tuberculosis Meromycolate extension acyl carrier protein AcpM 0.0417 0.0502 0.044
Mycobacterium ulcerans acyl carrier protein 0.0417 0.0502 0.0353
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.011 0.0107 0.0107
Loa Loa (eye worm) carbonic anhydrase 3 0.0203 0.0227 0.0245
Leishmania major nuclear receptor binding factor-like protein 0.0257 0.0295 0.1878
Brugia malayi Alcohol dehydrogenase class III 0.0257 0.0295 0.0295
Mycobacterium tuberculosis Polyketide synthase Pks2 0.4004 0.5108 0.6413
Leishmania major NADP-dependent alcohol dehydrogenase, putative 0.0257 0.0295 0.1878
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsB 0.0634 0.078 0.0801
Trypanosoma cruzi NADP-dependent alcohol hydrogenase, putative 0.0257 0.0295 0.2264
Mycobacterium tuberculosis Probable alcohol dehydrogenase Adh 0.0257 0.0295 0.0173
Loa Loa (eye worm) hypothetical protein 0.011 0.0107 0.0109
Schistosoma mansoni alcohol dehydrogenase 0.0257 0.0295 0.1833
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.0203 0.0227 0.1393
Loa Loa (eye worm) acyl carrier protein 0.1899 0.2405 0.2706
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsC 0.4115 0.525 0.6598
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsD 0.4115 0.525 0.6567
Toxoplasma gondii quinone oxidoreductase, putative 0.0257 0.0295 0.0511
Mycobacterium ulcerans quinone reductase Qor 0.0257 0.0295 0.0083
Entamoeba histolytica NADP-dependent alcohol dehydrogenase, putative 0.0257 0.0295 0.5504
Trichomonas vaginalis alcohol dehydrogenase, putative 0.0257 0.0295 0.1878
Mycobacterium leprae Probable fatty-acid-CoA synthetase FadD22 (fatty-acid-CoA ligase) (fatty-acid-CoA synthase) 0.0425 0.0512 0.0285
Mycobacterium ulcerans zinc-dependent alcohol dehydrogenase 0.0257 0.0295 0.0083
Trypanosoma cruzi nuclear receptor binding factor, putative 0.0257 0.0295 0.2264
Schistosoma mansoni hypothetical protein 0.0205 0.0229 0.1404
Echinococcus multilocularis para nitrobenzyl esterase 0.0207 0.0232 0.1446
Echinococcus multilocularis Malonyl coenzyme A acyl carrier protein transacylase 0.0261 0.0301 0.1899
Onchocerca volvulus 0.0425 0.0512 0.0301
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0207 0.0232 0.1423
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0884 0.1101 0.7136
Mycobacterium ulcerans polyketide synthase 0.4115 0.525 0.6567
Brugia malayi Importin beta-1 subunit 0.0035 0.0011 0.0011
Leishmania major hypothetical protein, conserved 0.1244 0.1564 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0425 0.0512 0.0512
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0207 0.0232 0.1423
Loa Loa (eye worm) hypothetical protein 0.0207 0.0232 0.025
Mycobacterium ulcerans quinone oxidoreductase 0.0257 0.0295 0.0083
Entamoeba histolytica acyl-CoA synthetase, putative 0.0418 0.0503 0.9403
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0109 0.0106 0.0613
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0372 0.0443 0.0489
Loa Loa (eye worm) hypothetical protein 0.0257 0.0295 0.0322
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0112 0.0109 0.0635
Toxoplasma gondii type I fatty acid synthase, putative 0.4372 0.5581 1
Mycobacterium tuberculosis Conserved hypothetical protein 0.0417 0.0502 0.044
Loa Loa (eye worm) carboxylesterase 0.0207 0.0232 0.025
Toxoplasma gondii type I fatty acid synthase, putative 0.294 0.3742 0.6698
Mycobacterium tuberculosis Probable polyketide synthase Pks8 0.3362 0.4284 0.5345
Mycobacterium tuberculosis Peptide synthetase MbtF (peptide synthase) 0.0425 0.0512 0.0453
Schistosoma mansoni hypothetical protein 0.0044 0.0023 0.0079
Loa Loa (eye worm) hypothetical protein 0.0035 0.0012 0.0001
Mycobacterium tuberculosis Probable polyketide synthase Pks17 0.1009 0.1262 0.1426
Loa Loa (eye worm) hypothetical protein 0.0106 0.0103 0.0104
Wolbachia endosymbiont of Brugia malayi ACP S-malonyltransferase 0.0261 0.0301 0.0053
Leishmania major acyl carrier protein, putative 0.0417 0.0502 0.3199
Leishmania major quinone oxidoreductase, putative 0.0257 0.0295 0.1878
Echinococcus granulosus acetylcholinesterase 0.1224 0.1538 1
Mycobacterium ulcerans acyl carrier protein 0.0417 0.0502 0.0353
Trypanosoma brucei oxidoreductase, putative 0.0257 0.0295 0.2213
Toxoplasma gondii Zn-containing alcohol dehydrogenase 0.0257 0.0295 0.0511
Mycobacterium ulcerans polyketide synthase Pks13 0.6158 0.7874 1
Echinococcus granulosus carbonic anhydrase 0.011 0.0107 0.0633
Mycobacterium ulcerans NADP-dependent alcohol dehydrogenase Adh 0.0257 0.0295 0.0083
Leishmania major zinc binding dehydrogenase-like protein 0.0257 0.0295 0.1878
Trypanosoma cruzi acyl transferase-like protein, putative 0.0261 0.0301 0.2305
Loa Loa (eye worm) hypothetical protein 0.0207 0.0232 0.025
Loa Loa (eye worm) beta-ketoacyl synthase domain-containing protein 0.1037 0.1297 0.1454
Echinococcus multilocularis carbonic anhydrase 0.011 0.0107 0.0633
Mycobacterium ulcerans thioesterase TesA 0.3442 0.4386 0.5436
Mycobacterium ulcerans Type I modular polyketide synthase 0.4115 0.525 0.6567
Plasmodium vivax malonyl CoA-acyl carrier protein transacylase precursor, putative 0.0261 0.0301 0.2255
Mycobacterium tuberculosis Probable polyketide synthase Pks9 0.2348 0.2982 0.3656
Mycobacterium tuberculosis Possible quinone oxidoreductase (NADPH:quinone oxidoreductase) (zeta-crystallin) 0.0257 0.0295 0.0173
Mycobacterium leprae PROBABLE THIOESTERASE TESA 0.3442 0.4386 0.5398
Loa Loa (eye worm) hypothetical protein 0.0046 0.0025 0.0016
Echinococcus multilocularis acetylcholinesterase 0.1224 0.1538 1
Trypanosoma brucei Trans-2-enoyl-ACP reductase 2, putative 0.0257 0.0295 0.2213
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.0203 0.0227 0.1736
Schistosoma mansoni hypothetical protein 0.0044 0.0023 0.0079
Echinococcus granulosus NADH dehydrogenase 0.0417 0.0502 0.3214
Mycobacterium ulcerans phenyloxazoline synthase MbtB 0.0425 0.0512 0.0366
Mycobacterium ulcerans polyketide synthase Pks9 0.2716 0.3454 0.4216
Schistosoma mansoni neuroligin 3 (S09 family) 0.0207 0.0232 0.1423
Toxoplasma gondii beta-ketoacyl synthase, N-terminal domain-containing protein 0.2679 0.3407 0.6097
Echinococcus granulosus Malonyl coenzyme A acyl carrier protein transacylase 0.0261 0.0301 0.1899
Echinococcus granulosus Niemann Pick C1 protein 0.0153 0.0163 0.0996
Mycobacterium tuberculosis Probable polyketide synthase Pks5 0.4004 0.5108 0.6413
Mycobacterium ulcerans thioesterase 0.3442 0.4386 0.5436
Trypanosoma cruzi beta-ketoacyl synthase family protein, putative 0.1037 0.1297 1
Toxoplasma gondii type I fatty acid synthase 0.0634 0.078 0.138
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD9 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0418 0.0503 0.0442
Entamoeba histolytica NADP-dependent alcohol dehydrogenase 0.0257 0.0295 0.5504
Mycobacterium tuberculosis Possible oxidoreductase FadB5 0.0257 0.0295 0.0173
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.0107 0.0104 0.1906
Mycobacterium tuberculosis Probable polyketide synthase Pks1 0.2967 0.3776 0.4687
Mycobacterium tuberculosis Hypothetical protein 0.1244 0.1564 0.1818
Trypanosoma brucei acyl transferase-like protein 0.0261 0.0301 0.2255
Mycobacterium ulcerans malonyl CoA-acyl carrier protein transacylase FabD 0.0261 0.0301 0.009
Schistosoma mansoni carbonic anhydrase-related 0.011 0.0107 0.0623
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.0203 0.0227 0.1736
Brugia malayi oxidoreductase, zinc-binding dehydrogenase family protein 0.0257 0.0295 0.0295
Schistosoma mansoni [ACP] S-malonyltransferase 0.0261 0.0301 0.1868
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsB 0.3308 0.4214 0.5211
Leishmania major oxidoreductase-like protein 0.0257 0.0295 0.1878
Echinococcus granulosus geminin 0.0205 0.0229 0.1428
Brugia malayi hypothetical protein 0.0207 0.0232 0.0232
Trypanosoma brucei Acyl carrier protein, mitochondrial 0.0417 0.0502 0.3816
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0112 0.0109 0.0646
Mycobacterium ulcerans oxidoreductase 0.0257 0.0295 0.0083
Mycobacterium ulcerans 3-oxoacyl-(acyl carrier protein) synthase II 0.1037 0.1297 0.1394
Plasmodium vivax 3-oxoacyl-[acyl-carrier-protein] synthase i/ii, putative 0.1037 0.1297 1
Mycobacterium tuberculosis Carboxylesterase LipT 0.0207 0.0232 0.009
Onchocerca volvulus 0.3866 0.4932 0.5056
Brugia malayi Carboxylesterase family protein 0.0207 0.0232 0.0232
Brugia malayi RNA, U transporter 1 0.0099 0.0093 0.0093
Wolbachia endosymbiont of Brugia malayi 3-oxoacyl-ACP synthase 0.1037 0.1297 1
Mycobacterium tuberculosis Polyketide synthase Pks12 0.4371 0.558 0.7025
Trypanosoma cruzi beta-ketoacyl synthase family protein, putative 0.1037 0.1297 1
Echinococcus multilocularis acetylcholinesterase 0.1224 0.1538 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 12.5893 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Rango (Ran-regulated importin-beta cargo) - Importin beta complex formation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID540273] ChEMBL. No reference
Potency (functional) 125.8925 uM PubChem BioAssay. qHTS of PTHR Inhibitors: Primary Screen. (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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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