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
Plasmodium falciparum importin beta, 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
Candida albicans karyopherin-beta Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma japonicum Snurportin-1, putative Get druggable targets OG5_131808 All targets in OG5_131808
Leishmania donovani importin beta-1 subunit, 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
Leishmania mexicana importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus granulosus snurportin 1 Get druggable targets OG5_131808 All targets in OG5_131808
Theileria parva importin beta, 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
Trichomonas vaginalis 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
Schistosoma japonicum Importin subunit beta-1, 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
Neospora caninum hypothetical protein 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
Trypanosoma cruzi importin beta-1 subunit, putative 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
Babesia bovis importin beta 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
Trichomonas vaginalis 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
Trichomonas vaginalis importin beta-1, 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
Leishmania braziliensis importin beta-1 subunit, 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
Trypanosoma brucei 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
Echinococcus multilocularis importin subunit beta 1 Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma japonicum Importin subunit beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Cryptosporidium hominis importin-beta2 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
Brugia malayi Importin beta-1 subunit Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma mansoni importin beta-1 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
Schistosoma mansoni hypothetical protein Get druggable targets OG5_131808 All targets in OG5_131808
Echinococcus multilocularis snurportin 1 Get druggable targets OG5_131808 All targets in OG5_131808
Entamoeba histolytica hypothetical protein Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania major importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
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 multilocularis para nitrobenzyl esterase 0.0207 0.0232 0.1446
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0112 0.0109 0.0111
Trypanosoma brucei oxidoreductase, putative 0.0257 0.0295 0.2213
Loa Loa (eye worm) hypothetical protein 0.0634 0.078 0.0869
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0372 0.0443 0.0489
Plasmodium falciparum acyl carrier protein 0.0417 0.0502 0.3816
Schistosoma mansoni gliotactin 0.0207 0.0232 0.1423
Echinococcus granulosus 3 oxoacyl acyl carrier protein synthase 0.1037 0.1297 0.8422
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.0203 0.0227 0.0245
Echinococcus multilocularis carbonic anhydrase 0.011 0.0107 0.0633
Entamoeba histolytica acyl-CoA synthetase, putative 0.0418 0.0503 0.9403
Brugia malayi hypothetical protein 0.0207 0.0232 0.0232
Mycobacterium ulcerans phenyloxazoline synthase MbtB 0.0425 0.0512 0.0366
Toxoplasma gondii quinone oxidoreductase, putative 0.0257 0.0295 0.0511
Entamoeba histolytica acyl-CoA synthetase, putative 0.0443 0.0535 1
Plasmodium falciparum malonyl CoA-acyl carrier protein transacylase 0.0261 0.0301 0.2255
Mycobacterium ulcerans oxidoreductase 0.0257 0.0295 0.0083
Schistosoma mansoni acyl carrier protein 0.0417 0.0502 0.3162
Trypanosoma brucei beta-ketoacyl-ACP synthase 0.1037 0.1297 1
Plasmodium falciparum ataxin-2 like protein, putative 0.0041 0.0019 0.0062
Schistosoma mansoni hypothetical protein 0.0205 0.0229 0.1404
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0035 0.0012 0.0012
Mycobacterium ulcerans non-ribosomal peptide synthetase MbtF 0.0425 0.0512 0.0366
Onchocerca volvulus 0.0257 0.0295 0.0069
Brugia malayi Alcohol dehydrogenase class III 0.0257 0.0295 0.0295
Loa Loa (eye worm) hypothetical protein 0.2299 0.2918 0.3286
Loa Loa (eye worm) phosphopantetheine attachment site family protein 0.0417 0.0502 0.0555
Mycobacterium tuberculosis Probable polyketide synthase Pks15 0.167 0.2111 0.2527
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.011 0.0107 0.0109
Schistosoma mansoni hypothetical protein 0.011 0.0107 0.0623
Loa Loa (eye worm) hypothetical protein 0.0046 0.0025 0.0016
Mycobacterium ulcerans Type I modular polyketide synthase 0.4115 0.525 0.6567
Loa Loa (eye worm) hypothetical protein 0.0257 0.0295 0.0322
Brugia malayi oxidoreductase, zinc-binding dehydrogenase family protein 0.0257 0.0295 0.0295
Echinococcus multilocularis expressed conserved protein 0.0101 0.0095 0.0555
Plasmodium vivax acyl carrier protein, putative 0.0417 0.0502 0.3816
Onchocerca volvulus 0.0425 0.0512 0.0301
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0207 0.0232 0.1423
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSC 0.4371 0.558 0.6973
Brugia malayi hypothetical protein 0.0041 0.0019 0.0019
Trypanosoma brucei PAB1-binding protein , putative 0.0041 0.0019 0.0062
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0112 0.0109 0.0635
Loa Loa (eye worm) AMP-binding enzyme family protein 0.3866 0.4932 0.5562
Loa Loa (eye worm) hypothetical protein 0.0106 0.0103 0.0104
Loa Loa (eye worm) acyl carrier protein 0.0417 0.0502 0.0555
Echinococcus multilocularis Malonyl coenzyme A acyl carrier protein transacylase 0.0261 0.0301 0.1899
Mycobacterium ulcerans 3-oxoacyl-(acyl carrier protein) synthase II 0.1037 0.1297 0.1394
Entamoeba histolytica NADP-dependent alcohol dehydrogenase, putative 0.0257 0.0295 0.5504
Schistosoma mansoni alcohol dehydrogenase 0.0257 0.0295 0.1833
Brugia malayi Carboxylesterase family protein 0.1224 0.1538 0.1538
Mycobacterium tuberculosis Phenyloxazoline synthase MbtB (phenyloxazoline synthetase) 0.3866 0.4932 0.6185
Mycobacterium leprae PROBABLE POLYKETIDE BETA-KETOACYL SYNTHASE PKS4 0.0634 0.078 0.0639
Schistosoma mansoni zinc binding dehydrogenase 0.0257 0.0295 0.1833
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0425 0.0512 0.0512
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.011 0.0107 0.0107
Mycobacterium tuberculosis Meromycolate extension acyl carrier protein AcpM 0.0417 0.0502 0.044
Schistosoma mansoni patched 1 0.0046 0.0025 0.0093
Schistosoma mansoni hypothetical protein 0.0044 0.0023 0.0079
Trypanosoma brucei oxidoreductase, putative 0.0257 0.0295 0.2213
Mycobacterium tuberculosis Carboxylesterase LipT 0.0207 0.0232 0.009
Schistosoma mansoni hypothetical protein 0.0372 0.0443 0.2786
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsA 0.4115 0.525 0.6598
Trypanosoma cruzi beta-ketoacyl synthase family protein, putative 0.1037 0.1297 1
Echinococcus granulosus carboxylesterase 5A 0.1224 0.1538 1
Brugia malayi oxidoreductase, zinc-binding dehydrogenase family protein 0.0257 0.0295 0.0295
Trichomonas vaginalis conserved hypothetical protein 0.1244 0.1564 1
Trichomonas vaginalis alcohol dehydrogenase, putative 0.0257 0.0295 0.1878
Loa Loa (eye worm) hypothetical protein 0.0634 0.078 0.0869
Brugia malayi Phosphopantetheine attachment site family protein 0.0417 0.0502 0.0502
Trypanosoma cruzi NADP-dependent alcohol hydrogenase, putative 0.0257 0.0295 0.2264
Trichomonas vaginalis spcc417.12 protein, putative 0.0207 0.0232 0.1469
Brugia malayi Carboxylesterase family protein 0.1224 0.1538 0.1538
Mycobacterium ulcerans acyl carrier protein 0.0417 0.0502 0.0353
Schistosoma mansoni hypothetical protein 0.0417 0.0502 0.3162
Toxoplasma gondii type I fatty acid synthase, putative 0.4372 0.5581 1
Toxoplasma gondii Zn-containing alcohol dehydrogenase 0.0257 0.0295 0.0511
Mycobacterium ulcerans polyketide synthase 0.4371 0.558 0.6998
Mycobacterium ulcerans zinc-dependent alcohol dehydrogenase AdhE2 0.0257 0.0295 0.0083
Onchocerca volvulus 0.7196 0.9208 0.9656
Toxoplasma gondii 3-oxoacyl-acyl-carrier protein synthase I/II, putative 0.1037 0.1297 0.231
Echinococcus granulosus Niemann Pick C1 protein 0.0153 0.0163 0.0996
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsB 0.0634 0.078 0.0801
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSB 0.3308 0.4214 0.5171
Mycobacterium tuberculosis Probable alcohol dehydrogenase Adh 0.0257 0.0295 0.0173
Mycobacterium leprae Probable multifunctional mycocerosic acid synthase membrane associated enzyme Mas 0.4371 0.558 0.6973
Loa Loa (eye worm) carboxylesterase 0.0207 0.0232 0.025
Echinococcus granulosus BC026374 protein S09 family 0.0207 0.0232 0.1446
Mycobacterium ulcerans fatty-acid-CoA ligase FadD9 0.0418 0.0503 0.0355
Mycobacterium ulcerans zinc-containing alcohol dehydrogenase NAD-dependent AdhB 0.0257 0.0295 0.0083
Mycobacterium ulcerans polyketide synthase Pks9 0.2716 0.3454 0.4216
Mycobacterium tuberculosis Probable fatty acid synthase Fas (fatty acid synthetase) 0.1297 0.1632 0.1906
Echinococcus granulosus tachykinin peptides receptor 99D 0.0338 0.0401 0.2552
Loa Loa (eye worm) hypothetical protein 0.0207 0.0232 0.025
Onchocerca volvulus 0.3866 0.4932 0.5056
Mycobacterium tuberculosis Probable acyl carrier protein AcpA (ACP) 0.0417 0.0502 0.044
Brugia malayi Methyltransferase-like protein 4 0.1244 0.1564 0.1564
Schistosoma mansoni [ACP] S-malonyltransferase 0.0261 0.0301 0.1868
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsE 0.0634 0.078 0.0801
Mycobacterium leprae Polyketide synthase Pks13 0.6158 0.7874 1
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0884 0.1101 0.7136
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0112 0.0109 0.0646
Echinococcus granulosus Niemann Pick C1 protein 0.0107 0.0104 0.0609
Mycobacterium tuberculosis Probable polyketide synthase Pks1 0.2967 0.3776 0.4687
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.0203 0.0227 0.1393
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.0203 0.0227 0.1393
Mycobacterium ulcerans polyketide synthase 0.4115 0.525 0.6567
Loa Loa (eye worm) hypothetical protein 0.0041 0.0019 0.0009
Trypanosoma cruzi NADP-dependent alcohol hydrogenase, putative 0.0257 0.0295 0.2264
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0207 0.0232 0.1423
Wolbachia endosymbiont of Brugia malayi 3-oxoacyl-ACP synthase 0.1037 0.1297 1
Trypanosoma cruzi PAB1-binding protein , putative 0.0041 0.0019 0.0127
Mycobacterium ulcerans thioesterase 0.3442 0.4386 0.5436
Trypanosoma cruzi nuclear receptor binding factor, putative 0.0257 0.0295 0.2264
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSA 0.4115 0.525 0.6538
Leishmania major carbonic anhydrase-like protein 0.0203 0.0227 0.144
Mycobacterium ulcerans acyl carrier protein 0.0417 0.0502 0.0353
Echinococcus granulosus carbonic anhydrase II 0.0203 0.0227 0.1417
Giardia lamblia Methyltransferase like 2 0.1244 0.1564 0.5
Mycobacterium ulcerans Type I modular polyketide synthase 0.4115 0.525 0.6567
Brugia malayi Carboxylesterase family protein 0.0207 0.0232 0.0232
Mycobacterium tuberculosis Probable zinc-type alcohol dehydrogenase AdhD (aldehyde reductase) 0.0257 0.0295 0.0173
Echinococcus granulosus expressed conserved protein 0.0101 0.0095 0.0555
Mycobacterium ulcerans polyketide synthase Pks13 0.6158 0.7874 1
Leishmania major d-xylulose reductase, putative 0.0257 0.0295 0.1878
Mycobacterium ulcerans multifunctional mycocerosic acid synthase membrane-associated Mas 0.4371 0.558 0.6998
Mycobacterium tuberculosis Probable NADPH quinone oxidoreductase FadB4 (NADPH:quinone reductase) (zeta-crystallin) 0.0257 0.0295 0.0173
Echinococcus multilocularis neuroligin 0.0207 0.0232 0.1446
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.0203 0.0227 0.1736
Brugia malayi RNA, U transporter 1 0.0099 0.0093 0.0093
Echinococcus granulosus carbonic anhydrase 0.011 0.0107 0.0633
Mycobacterium tuberculosis Polyketide synthase Pks2 0.4004 0.5108 0.6413
Loa Loa (eye worm) hypothetical protein 0.0207 0.0232 0.025
Loa Loa (eye worm) hypothetical protein 0.0207 0.0232 0.025
Echinococcus granulosus para nitrobenzyl esterase 0.0207 0.0232 0.1446
Echinococcus granulosus geminin 0.0205 0.0229 0.1428
Schistosoma mansoni acetylcholinesterase 0.0207 0.0232 0.1423
Mycobacterium tuberculosis Polyketide synthetase MbtC (polyketide synthase) 0.1404 0.177 0.2084
Echinococcus multilocularis snurportin 1 0.0372 0.0443 0.2832
Leishmania major NADP-dependent alcohol dehydrogenase, putative 0.0257 0.0295 0.1878
Mycobacterium tuberculosis Probable polyketide synthase Pks7 0.4371 0.558 0.7025
Mycobacterium leprae PROBABLE FATTY ACID SYNTHASE FAS (FATTY ACID SYNTHETASE) 0.1297 0.1632 0.1764
Echinococcus multilocularis muscleblind protein 1 0.0106 0.0103 0.0601
Toxoplasma gondii AMP-binding enzyme domain-containing protein 0.2088 0.2648 0.4734
Echinococcus multilocularis Niemann Pick C1 protein 0.0107 0.0104 0.0609
Echinococcus granulosus neuroligin 0.0207 0.0232 0.1446
Mycobacterium leprae PROBABLE THIOESTERASE TESA 0.3442 0.4386 0.5398
Echinococcus granulosus muscleblind protein 0.0106 0.0103 0.0601
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0112 0.0109 0.0635
Schistosoma mansoni carbonic anhydrase-related 0.011 0.0107 0.0623
Onchocerca volvulus Fatty acid synthase homolog 0.7445 0.9528 1
Mycobacterium ulcerans quinone reductase Qor 0.0257 0.0295 0.0083
Echinococcus granulosus acetylcholinesterase 0.1224 0.1538 1
Mycobacterium tuberculosis Peptide synthetase MbtE (peptide synthase) 0.0425 0.0512 0.0453
Loa Loa (eye worm) hypothetical protein 0.0207 0.0232 0.025
Trypanosoma cruzi NADP-dependent alcohol hydrogenase, putative 0.0257 0.0295 0.2264
Echinococcus multilocularis family S9 non peptidase ue (S09 family) 0.0207 0.0232 0.1446
Chlamydia trachomatis 3-oxoacyl-ACP synthase 0.1037 0.1297 1
Loa Loa (eye worm) hypothetical protein 0.0261 0.0301 0.0328
Loa Loa (eye worm) hypothetical protein 0.0207 0.0232 0.025
Mycobacterium tuberculosis Possible oxidoreductase FadB5 0.0257 0.0295 0.0173
Brugia malayi ADP-specific Phosphofructokinase/Glucokinase conserved region family protein 0.0261 0.0301 0.0301
Brugia malayi Carboxylesterase family protein 0.0207 0.0232 0.0232
Schistosoma mansoni BC026374 protein (S09 family) 0.0207 0.0232 0.1423
Toxoplasma gondii LsmAD domain-containing protein 0.0041 0.0019 0.0014
Leishmania major zinc binding dehydrogenase-like protein 0.0257 0.0295 0.1878
Leishmania major oxidoreductase-like protein 0.0257 0.0295 0.1878
Schistosoma mansoni hypothetical protein 0.0044 0.0023 0.0079
Echinococcus multilocularis AMP dependent ligase 0.0418 0.0503 0.3223
Echinococcus granulosus Malonyl coenzyme A acyl carrier protein transacylase 0.0261 0.0301 0.1899
Mycobacterium ulcerans NADP-dependent alcohol dehydrogenase AdhC 0.0257 0.0295 0.0083
Trypanosoma cruzi PAB1-binding protein , putative 0.0041 0.0019 0.0127
Echinococcus granulosus Protein patched homolog 1 0.0046 0.0025 0.0094
Echinococcus multilocularis muscleblind protein 0.0106 0.0103 0.0601
Loa Loa (eye worm) hypothetical protein 0.0257 0.0295 0.0322
Trypanosoma cruzi NADP-dependent alcohol hydrogenase, putative 0.0257 0.0295 0.2264
Onchocerca volvulus Putative alcohol dehydrogenase 0.0257 0.0295 0.0069
Entamoeba histolytica NADP-dependent alcohol dehydrogenase 0.0257 0.0295 0.5504
Plasmodium falciparum carbonic anhydrase 0.011 0.0107 0.0752
Brugia malayi AMP-binding enzyme family protein 0.3866 0.4932 0.4932
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsC 0.4371 0.558 0.6998
Echinococcus multilocularis protein dispatched 1 0.0053 0.0033 0.0149
Mycobacterium tuberculosis P-hydroxybenzoyl-AMP ligase FadD22 0.0425 0.0512 0.0453
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.011 0.0107 0.0107
Trypanosoma brucei acyl transferase-like protein 0.0261 0.0301 0.2255
Echinococcus granulosus NADH dehydrogenase 0.0417 0.0502 0.3214
Onchocerca volvulus Acyl carrier protein, mitochondrial homolog 0.0417 0.0502 0.0291
Loa Loa (eye worm) hypothetical protein 0.0207 0.0232 0.025
Loa Loa (eye worm) acetylcholinesterase 1 0.1224 0.1538 0.1727
Echinococcus multilocularis carboxylesterase 5A 0.1224 0.1538 1
Trichomonas vaginalis alcohol dehydrogenase, putative 0.0257 0.0295 0.1878
Leishmania major zinc-binding dehydrogenase-like protein 0.0257 0.0295 0.1878
Loa Loa (eye worm) hypothetical protein 0.0257 0.0295 0.0322
Loa Loa (eye worm) hypothetical protein 0.0207 0.0232 0.025
Echinococcus multilocularis carbonic anhydrase 0.011 0.0107 0.0633
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0112 0.0109 0.0635
Mycobacterium ulcerans quinone oxidoreductase 0.0257 0.0295 0.0083
Schistosoma mansoni [ACP] S-malonyltransferase 0.0261 0.0301 0.1868
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.1224 0.1538 0.9836
Loa Loa (eye worm) carboxylesterase 0.1224 0.1538 0.1727
Echinococcus multilocularis Acyl carrier protein, mitochondrial 0.0417 0.0502 0.3214
Echinococcus multilocularis carbonic anhydrase 0.011 0.0107 0.0633
Loa Loa (eye worm) hypothetical protein 0.1224 0.1538 0.1727
Mycobacterium ulcerans acyl-CoA synthetase 0.0425 0.0512 0.0366
Leishmania major hypothetical protein, conserved 0.0261 0.0301 0.1912
Onchocerca volvulus 0.0257 0.0295 0.0069
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsC 0.4115 0.525 0.6598
Trypanosoma cruzi Acyl carrier protein, mitochondrial, putative 0.0417 0.0502 0.3857
Brugia malayi Muscleblind-like protein 0.0106 0.0103 0.0103
Brugia malayi Calcitonin receptor-like protein seb-1 0.0035 0.0012 0.0012
Mycobacterium ulcerans NADPH quinone oxidoreductase FadB4 0.0257 0.0295 0.0083
Plasmodium vivax 3-oxoacyl-[acyl-carrier-protein] synthase i/ii, putative 0.1037 0.1297 1
Toxoplasma gondii beta-ketoacyl synthase, N-terminal domain-containing protein 0.2679 0.3407 0.6097
Mycobacterium tuberculosis Peptide synthetase MbtF (peptide synthase) 0.0425 0.0512 0.0453
Mycobacterium tuberculosis Probable quinone reductase Qor (NADPH:quinone reductase) (zeta-crystallin homolog protein) 0.0257 0.0295 0.0173
Echinococcus granulosus family S9 non peptidase ue S09 family 0.0207 0.0232 0.1446
Mycobacterium ulcerans polyketide synthase MbtD 0.127 0.1597 0.1786
Trypanosoma cruzi oxidoreductase, putative 0.0257 0.0295 0.2264
Loa Loa (eye worm) hypothetical protein 0.011 0.0107 0.0109
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
Echinococcus granulosus snurportin 1 0.0372 0.0443 0.2832
Brugia malayi Carboxylesterase family protein 0.0207 0.0232 0.0232
Plasmodium vivax hypothetical protein, conserved 0.0592 0.0726 0.5561
Brugia malayi Importin beta-1 subunit 0.0035 0.0011 0.0011
Schistosoma mansoni methyltransferase-related 0.1244 0.1564 1
Wolbachia endosymbiont of Brugia malayi acyl carrier protein 0.0417 0.0502 0.2059
Loa Loa (eye worm) fatty acid synthase 0.4075 0.52 0.5865
Echinococcus multilocularis 3 oxoacyl (acyl carrier protein) synthase 0.1037 0.1297 0.8422
Mycobacterium ulcerans non-ribosomal peptide synthetase MbtE 0.0425 0.0512 0.0366
Trypanosoma brucei Acyl carrier protein, mitochondrial 0.0417 0.0502 0.3816
Mycobacterium ulcerans NADP-dependent alcohol dehydrogenase Adh 0.0257 0.0295 0.0083
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0203 0.0227 0.0227
Toxoplasma gondii type I fatty acid synthase, putative 0.294 0.3742 0.6698
Schistosoma mansoni 3-oxoacyl-[ACP] synthase 0.1037 0.1297 0.8284
Mycobacterium tuberculosis Hypothetical protein 0.1244 0.1564 0.1818
Mycobacterium tuberculosis Probable polyketide beta-ketoacyl synthase Pks3 0.0634 0.078 0.0801
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0112 0.0109 0.0109
Leishmania major beta-ketoacyl synthase family protein, putative,3-oxoacyl-acyl carrier protein synthase ii, putative 0.1037 0.1297 0.8293
Schistosoma mansoni [ACP] S-malonyltransferase 0.0261 0.0301 0.1868
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0592 0.0726 0.5561
Trichomonas vaginalis conserved hypothetical protein 0.0046 0.0025 0.0146
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0207 0.0232 0.1423
Loa Loa (eye worm) carboxylesterase 0.0207 0.0232 0.025
Echinococcus multilocularis acetylcholinesterase 0.1224 0.1538 1
Echinococcus multilocularis carbonic anhydrase II 0.0203 0.0227 0.1417
Trypanosoma brucei carbonic anhydrase-like protein 0.0203 0.0227 0.1682
Leishmania major quinone oxidoreductase, putative 0.0257 0.0295 0.1878
Trypanosoma cruzi beta-ketoacyl synthase family protein, putative 0.1037 0.1297 1
Trypanosoma cruzi oxidoreductase, putative 0.0257 0.0295 0.2264
Echinococcus granulosus acetylcholinesterase 0.1224 0.1538 1
Loa Loa (eye worm) hypothetical protein 0.0107 0.0104 0.0105
Loa Loa (eye worm) hypothetical protein 0.0056 0.0038 0.0031
Toxoplasma gondii acyl carrier protein ACP 0.0417 0.0502 0.0881
Plasmodium vivax malonyl CoA-acyl carrier protein transacylase precursor, putative 0.0261 0.0301 0.2255
Leishmania major hypothetical protein, conserved 0.0041 0.0019 0.0105
Trypanosoma cruzi nuclear receptor binding factor, putative 0.0257 0.0295 0.2264
Mycobacterium tuberculosis Probable membrane bound polyketide synthase Pks6 0.6158 0.7874 1
Entamoeba histolytica NADP-dependent alcohol dehydrogenase, putative 0.0257 0.0295 0.5504
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.011 0.0107 0.0107
Mycobacterium ulcerans oxidoreductase FadB5 0.0257 0.0295 0.0083
Echinococcus multilocularis Niemann Pick C1 protein 0.0153 0.0163 0.0996
Echinococcus multilocularis protein patched 0.0046 0.0025 0.0094
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.0203 0.0227 0.1736
Trypanosoma brucei Trans-2-enoyl-ACP reductase 2, putative 0.0257 0.0295 0.2213
Treponema pallidum acyl carrier protein 0.0417 0.0502 0.5
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.0107 0.0104 0.1906
Echinococcus granulosus mitochondrial trans 2 enoyl coenzyme A reductase 0.0257 0.0295 0.1864
Mycobacterium tuberculosis Probable peptide synthetase Nrp (peptide synthase) 0.0425 0.0512 0.0453
Brugia malayi CHE-14 protein 0.0046 0.0025 0.0025
Plasmodium falciparum ataxin-2 like protein, putative 0.0041 0.0019 0.0062
Brugia malayi Beta-ketoacyl synthase, N-terminal domain containing protein 0.1037 0.1297 0.1297
Mycobacterium ulcerans zinc-dependent alcohol dehydrogenase 0.0257 0.0295 0.0083
Mycobacterium ulcerans zinc-containing alcohol dehydrogenase NAD dependent AdhB 0.0257 0.0295 0.0083
Mycobacterium tuberculosis S-nitrosomycothiol reductase MscR 0.0257 0.0295 0.0173
Loa Loa (eye worm) hypothetical protein 0.6924 0.8858 1
Trichomonas vaginalis carboxylesterase domain containing protein, putative 0.0207 0.0232 0.1469
Trypanosoma cruzi oxidoreductase, putative 0.0257 0.0295 0.2264
Mycobacterium tuberculosis Conserved protein 0.1244 0.1564 0.1818
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsE 0.2716 0.3454 0.4216
Trypanosoma cruzi acyl transferase-like protein 0.0261 0.0301 0.2305
Leishmania major nuclear receptor binding factor-like protein 0.0257 0.0295 0.1878
Loa Loa (eye worm) carbonic anhydrase 3 0.0203 0.0227 0.0245
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0112 0.0109 0.0646
Mycobacterium ulcerans short-chain dehydrogenase 0.0257 0.0295 0.0083
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsA 0.3308 0.4214 0.5211
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsD 0.4115 0.525 0.6567
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0109 0.0106 0.0613
Toxoplasma gondii type I fatty acid synthase 0.0634 0.078 0.138
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSD 0.4115 0.525 0.6538
Mycobacterium tuberculosis Possible quinone oxidoreductase (NADPH:quinone oxidoreductase) (zeta-crystallin) 0.0257 0.0295 0.0173
Brugia malayi acyl carrier protein, mitochondrial precursor, putative 0.0417 0.0502 0.0502
Echinococcus granulosus sterol regulatory element binding protein 0.0046 0.0025 0.0094
Leishmania major oxidoreductase, putative 0.0257 0.0295 0.1878
Mycobacterium ulcerans dehydrogenase 0.0257 0.0295 0.0083
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsB 0.3308 0.4214 0.5211
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0207 0.0232 0.009
Mycobacterium ulcerans fatty acid synthase Fas 0.1297 0.1632 0.1833
Toxoplasma gondii acyl transferase domain-containing protein 0.0261 0.0301 0.0521
Mycobacterium tuberculosis Probable polyketide synthase Pks8 0.3362 0.4284 0.5345
Echinococcus granulosus acyl carrier protein mitochondrial 0.0417 0.0502 0.3214
Loa Loa (eye worm) hypothetical protein 0.0106 0.0103 0.0104
Schistosoma mansoni hypothetical protein 0.0044 0.0023 0.0079
Echinococcus multilocularis sterol regulatory element binding protein 0.0046 0.0025 0.0094
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0035 0.0012 0.0001
Plasmodium falciparum 3-oxoacyl-acyl-carrier protein synthase I/II 0.1037 0.1297 1
Mycobacterium ulcerans zinc-type alcohol dehydrogenase AdhD 0.0257 0.0295 0.0083
Wolbachia endosymbiont of Brugia malayi ACP S-malonyltransferase 0.0261 0.0301 0.0053
Mycobacterium ulcerans NADP-dependent oxidoreductase 0.0257 0.0295 0.0083
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsD 0.4115 0.525 0.6598
Mycobacterium tuberculosis Probable multifunctional mycocerosic acid synthase membrane-associated Mas 0.4371 0.558 0.7025
Brugia malayi Putative carbonic anhydrase 5 precursor 0.0203 0.0227 0.0227
Leishmania major acyl carrier protein, putative 0.0417 0.0502 0.3199
Schistosoma mansoni carbonic anhydrase 0.011 0.0107 0.0623
Echinococcus granulosus carbonic anhydrase 0.011 0.0107 0.0633
Brugia malayi Carboxylesterase family protein 0.0207 0.0232 0.0232
Mycobacterium tuberculosis Probable polyketide synthase Pks17 0.1009 0.1262 0.1426
Mycobacterium tuberculosis Probable polyketide synthase Pks9 0.2348 0.2982 0.3656
Toxoplasma gondii hypothetical protein 0.011 0.0107 0.0174
Echinococcus multilocularis geminin 0.0205 0.0229 0.1428
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.011 0.0107 0.0107
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0207 0.0232 0.009
Mycobacterium tuberculosis Acyl carrier protein (ACP) MbtL 0.0417 0.0502 0.044
Schistosoma mansoni neuroligin 3 (S09 family) 0.0207 0.0232 0.1423
Echinococcus multilocularis acetylcholinesterase 0.1224 0.1538 1
Brugia malayi AMP-binding enzyme family protein 0.1271 0.1598 0.1598
Mycobacterium tuberculosis Possible dehydrogenase 0.0257 0.0295 0.0173
Mycobacterium ulcerans hypothetical protein 0.0417 0.0502 0.0353
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD9 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0418 0.0503 0.0442
Echinococcus multilocularis NADH dehydrogenase 0.0417 0.0502 0.3214
Mycobacterium ulcerans quinone oxidoreductase 0.0257 0.0295 0.0083
Loa Loa (eye worm) hypothetical protein 0.011 0.0107 0.0109
Mycobacterium tuberculosis Conserved hypothetical protein 0.0417 0.0502 0.044
Loa Loa (eye worm) acyl carrier protein 0.1899 0.2405 0.2706
Echinococcus granulosus AMP dependent ligase 0.0418 0.0503 0.3223
Loa Loa (eye worm) hypothetical protein 0.0257 0.0295 0.0322
Mycobacterium ulcerans polyketide synthase MbtC 0.1037 0.1297 0.1394
Mycobacterium tuberculosis Possible dehydrogenase 0.0257 0.0295 0.0173
Mycobacterium ulcerans Zn-dependent alcohol dehydrogenase, AdhX 0.0257 0.0295 0.0083
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0338 0.0401 0.2552
Brugia malayi Niemann-Pick C1 protein precursor 0.0107 0.0104 0.0104
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0046 0.0025 0.0016
Mycobacterium tuberculosis Polyketide synthase Pks13 0.6158 0.7874 1
Mycobacterium ulcerans Type I modular polyketide synthase 0.4115 0.525 0.6567
Chlamydia trachomatis acyl carrier protein 0.0417 0.0502 0.2016
Schistosoma mansoni hypothetical protein 0.0205 0.0229 0.1404
Schistosoma mansoni carbonic anhydrase-related 0.011 0.0107 0.0623
Mycobacterium tuberculosis Probable thioesterase TesA 0.3442 0.4386 0.5477
Leishmania major hypothetical protein, conserved 0.1244 0.1564 1
Mycobacterium leprae Probable fatty-acid-CoA synthetase FadD22 (fatty-acid-CoA ligase) (fatty-acid-CoA synthase) 0.0425 0.0512 0.0285
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0112 0.0109 0.0646
Schistosoma mansoni hypothetical protein 0.0044 0.0023 0.0079
Echinococcus granulosus carbonic anhydrase 0.011 0.0107 0.0633
Schistosoma mansoni carbonic anhydrase-related 0.011 0.0107 0.0623
Mycobacterium tuberculosis Probable polyketide synthase Pks5 0.4004 0.5108 0.6413
Mycobacterium ulcerans 3-oxoacyl-(acyl carrier protein) synthase II 0.1037 0.1297 0.1394
Mycobacterium leprae Probable fatty-acid-CoA ligase FadD9 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0418 0.0503 0.0274
Mycobacterium ulcerans oxidoreductase 0.0257 0.0295 0.0083
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSE 0.2716 0.3454 0.4168
Trypanosoma cruzi acyl transferase-like protein, putative 0.0261 0.0301 0.2305
Mycobacterium tuberculosis Probable NADP-dependent alcohol dehydrogenase AdhC 0.0257 0.0295 0.0173
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.011 0.0107 0.0107
Plasmodium vivax ataxin-2 like protein, putative 0.0041 0.0019 0.0062
Brugia malayi oxidoreductase, zinc-binding dehydrogenase family protein 0.0257 0.0295 0.0295
Mycobacterium leprae Probable polyketide synthase Pks1 0.4371 0.558 0.6973
Mycobacterium leprae conserved hypothetical protein 0.0417 0.0502 0.0272
Mycobacterium tuberculosis Probable oxidoreductase 0.0257 0.0295 0.0173
Mycobacterium tuberculosis Probable alcohol dehydrogenase AdhA 0.0257 0.0295 0.0173
Trichomonas vaginalis alcohol dehydrogenase, putative 0.0257 0.0295 0.1878
Loa Loa (eye worm) hypothetical protein 0.1224 0.1538 0.1727
Mycobacterium tuberculosis Probable polyketide beta-ketoacyl synthase Pks4 0.0634 0.078 0.0801
Mycobacterium tuberculosis Polyketide synthase Pks12 0.4371 0.558 0.7025
Mycobacterium ulcerans thioesterase TesA 0.3442 0.4386 0.5436
Mycobacterium ulcerans non-ribosomal peptide synthetase 0.0418 0.0503 0.0355
Mycobacterium ulcerans malonyl CoA-acyl carrier protein transacylase FabD 0.0261 0.0301 0.009
Echinococcus multilocularis mitochondrial trans 2 enoyl coenzyme A reductase 0.0257 0.0295 0.1864
Loa Loa (eye worm) hypothetical protein 0.0035 0.0012 0.0001
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0112 0.0109 0.0646
Brugia malayi Beta-ketoacyl synthase, N-terminal domain containing protein 0.4115 0.525 0.525
Loa Loa (eye worm) beta-ketoacyl synthase domain-containing protein 0.1037 0.1297 0.1454
Loa Loa (eye worm) alcohol dehydrogenase class III 0.0257 0.0295 0.0322
Mycobacterium tuberculosis Polyketide synthetase MbtD (polyketide synthase) 0.127 0.1597 0.186
Loa Loa (eye worm) hypothetical protein 0.011 0.0107 0.0109

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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