Detailed information for compound 142406

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 518.612 | Formula: C30H30N8O
  • H donors: 1 H acceptors: 5 LogP: 3.19 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 2
  • SMILES: N#Cc1cccn1c1ncnc2c1ncn2CC(CN1CCN(CC1)C(c1ccccc1)c1ccccc1)O
  • InChi: 1S/C30H30N8O/c31-18-25-12-7-13-38(25)30-27-29(32-21-33-30)37(22-34-27)20-26(39)19-35-14-16-36(17-15-35)28(23-8-3-1-4-9-23)24-10-5-2-6-11-24/h1-13,21-22,26,28,39H,14-17,19-20H2
  • InChiKey: INZJCFBTGUJGRP-UHFFFAOYSA-N  

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

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

Obtained from network model

Ranking Plot


Putative Targets List


Species Potential target Raw Global Species
Loa Loa (eye worm) hypothetical protein 0.0072 0.0679 0.1081
Brugia malayi Beta-ketoacyl synthase, N-terminal domain containing protein 0.0077 0.0734 0.103
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0028 0.0115 0.0135
Schistosoma mansoni hypothetical protein 0.0039 0.0256 0.0302
Mycobacterium tuberculosis Probable esterase LipL 0.0072 0.0679 0.0962
Brugia malayi latrophilin 2 splice variant baaae 0.0039 0.0256 0.0359
Mycobacterium tuberculosis Polyketide synthetase MbtC (polyketide synthase) 0.0102 0.1063 0.1657
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsE 0.0047 0.0353 0.0371
Mycobacterium tuberculosis Probable lipase LipE 0.0072 0.0679 0.0962
Loa Loa (eye worm) hypothetical protein 0.0072 0.0679 0.1081
Loa Loa (eye worm) transcription factor SMAD2 0.0119 0.128 0.2037
Brugia malayi beta-lactamase family protein 0.0072 0.0679 0.0953
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.003 0.0136 0.0161
Schistosoma mansoni methyltransferase-related 0.0092 0.093 0.1098
Mycobacterium tuberculosis Probable polyketide synthase Pks5 0.0296 0.354 0.6146
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0072 0.0679 0.0802
Mycobacterium tuberculosis Polyketide synthase Pks13 0.0453 0.5558 0.9802
Mycobacterium tuberculosis Probable membrane bound polyketide synthase Pks6 0.0453 0.5558 0.9802
Schistosoma mansoni 3-oxoacyl-[ACP] synthase 0.0077 0.0734 0.0866
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSA 0.0302 0.3626 0.6429
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0044 0.0313 0.4269
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0037 0.0224 0.0264
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0072 0.0679 0.0962
Schistosoma mansoni aldehyde dehydrogenase 0.006 0.0521 0.0614
Mycobacterium ulcerans 3-oxoacyl-(acyl carrier protein) synthase II 0.0077 0.0734 0.132
Mycobacterium ulcerans peptide synthetase Nrp (peptide synthase) 0.0031 0.0148 0.0266
Mycobacterium tuberculosis Conserved protein 0.0072 0.0679 0.0962
Mycobacterium ulcerans acyl carrier protein 0.0031 0.0148 0.0266
Loa Loa (eye worm) hypothetical protein 0.0039 0.0256 0.0407
Mycobacterium ulcerans Type I modular polyketide synthase 0.0302 0.3626 0.6524
Trypanosoma cruzi beta-ketoacyl synthase family protein, putative 0.0077 0.0734 1
Mycobacterium ulcerans non-ribosomal peptide synthetase 0.0031 0.0148 0.0266
Mycobacterium tuberculosis Probable polyketide synthase Pks8 0.0247 0.2914 0.5012
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.0521 0.0937
Leishmania major hypothetical protein, conserved 0.0072 0.0679 0.7301
Mycobacterium ulcerans esterase/lipase LipP 0.0072 0.0679 0.1222
Loa Loa (eye worm) MH2 domain-containing protein 0.0119 0.128 0.2037
Leishmania major beta-ketoacyl synthase family protein, putative,3-oxoacyl-acyl carrier protein synthase ii, putative 0.0077 0.0734 0.789
Toxoplasma gondii type I fatty acid synthase 0.0047 0.0353 0.0911
Trypanosoma cruzi hypothetical protein, conserved 0.0072 0.0679 0.9253
Chlamydia trachomatis 3-oxoacyl-ACP synthase 0.0077 0.0734 1
Loa Loa (eye worm) AMP-binding enzyme family protein 0.0285 0.3403 0.5417
Onchocerca volvulus 0.0072 0.0679 0.0837
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0034 0.019 0.0224
Mycobacterium ulcerans acyl carrier protein 0.0031 0.0148 0.0266
Onchocerca volvulus 0.003 0.0136 0.0024
Mycobacterium leprae PROBABLE POLYKETIDE BETA-KETOACYL SYNTHASE PKS4 0.0047 0.0353 0.0378
Mycobacterium ulcerans fatty acid synthase Fas 0.0096 0.0981 0.1764
Mycobacterium ulcerans polyketide synthase 0.0302 0.3626 0.6524
Brugia malayi Beta-ketoacyl synthase, N-terminal domain containing protein 0.0302 0.3626 0.509
Mycobacterium ulcerans hypothetical protein 0.0031 0.0148 0.0266
Brugia malayi acyl carrier protein, mitochondrial precursor, putative 0.0031 0.0148 0.0208
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0205 0.2375 0.3781
Mycobacterium ulcerans fatty-acid-CoA ligase FadD9 0.0031 0.0148 0.0266
Onchocerca volvulus Huntingtin homolog 0.0121 0.1301 0.1769
Giardia lamblia Methyltransferase like 2 0.0092 0.093 0.5
Toxoplasma gondii AMP-binding enzyme domain-containing protein 0.0154 0.1728 0.4466
Echinococcus multilocularis geminin 0.0341 0.4123 0.4123
Brugia malayi beta-lactamase family protein 0.0072 0.0679 0.0953
Mycobacterium ulcerans thioesterase 0.0254 0.3009 0.5413
Mycobacterium tuberculosis Probable hydrolase 0.0072 0.0679 0.0962
Trichomonas vaginalis conserved hypothetical protein 0.0092 0.093 0.1221
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSE 0.0199 0.2303 0.3983
Schistosoma mansoni cpg binding protein 0.003 0.0142 0.0167
Mycobacterium ulcerans Type I modular polyketide synthase 0.0302 0.3626 0.6524
Schistosoma mansoni hypothetical protein 0.0037 0.0224 0.0264
Echinococcus granulosus acyl carrier protein mitochondrial 0.0031 0.0148 0.0175
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0072 0.0679 0.1081
Echinococcus granulosus histone lysine methyltransferase setb 0.003 0.0136 0.0161
Toxoplasma gondii ABC1 family protein 0.0072 0.0679 0.1755
Loa Loa (eye worm) acyl carrier protein 0.014 0.155 0.2467
Brugia malayi Methyltransferase-like protein 4 0.0092 0.093 0.1306
Brugia malayi oxidoreductase, zinc-binding dehydrogenase family protein 0.0576 0.7124 1
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0462 0.5668 1
Onchocerca volvulus 0.0031 0.0148 0.0041
Entamoeba histolytica hypothetical protein 0.0037 0.0224 1
Mycobacterium ulcerans polyketide synthase MbtC 0.0077 0.0734 0.132
Mycobacterium tuberculosis Probable polyketide beta-ketoacyl synthase Pks3 0.0047 0.0353 0.0371
Leishmania major hypothetical protein, conserved 0.0076 0.0726 0.7801
Brugia malayi AMP-binding enzyme family protein 0.0285 0.3403 0.4777
Mycobacterium leprae PROBABLE FATTY ACID SYNTHASE FAS (FATTY ACID SYNTHETASE) 0.0096 0.0981 0.1539
Loa Loa (eye worm) fatty acid synthase 0.0301 0.3608 0.5743
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsB 0.0243 0.2863 0.5151
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0093 0.0945 0.1115
Echinococcus multilocularis Acyl carrier protein, mitochondrial 0.0031 0.0148 0.0148
Entamoeba histolytica hypothetical protein 0.0037 0.0224 1
Mycobacterium tuberculosis Probable fatty acid synthase Fas (fatty acid synthetase) 0.0096 0.0981 0.1508
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0034 0.019 0.019
Trypanosoma cruzi hypothetical protein, conserved 0.0072 0.0679 0.9253
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsA 0.0302 0.3626 0.6301
Loa Loa (eye worm) hypothetical protein 0.0072 0.0679 0.1081
Mycobacterium tuberculosis Probable polyketide synthase Pks7 0.0321 0.3869 0.6741
Loa Loa (eye worm) hypothetical protein 0.0057 0.0488 0.0777
Plasmodium falciparum acyl carrier protein 0.0031 0.0148 0.2016
Echinococcus granulosus microtubule associated protein 2 0.0681 0.8473 1
Mycobacterium leprae PROBABLE THIOESTERASE TESA 0.0254 0.3009 0.5288
Mycobacterium leprae Polyketide synthase Pks13 0.0453 0.5558 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0679 0.1081
Loa Loa (eye worm) beta-ketoacyl synthase domain-containing protein 0.0077 0.0734 0.1168
Mycobacterium ulcerans non-ribosomal peptide synthetase MbtE 0.0031 0.0148 0.0266
Mycobacterium ulcerans lipase LipD 0.0072 0.0679 0.1222
Mycobacterium tuberculosis Probable polyketide beta-ketoacyl synthase Pks4 0.0047 0.0353 0.0371
Mycobacterium tuberculosis Polyketide synthetase MbtD (polyketide synthase) 0.0094 0.0955 0.1461
Brugia malayi MH2 domain containing protein 0.0119 0.128 0.1796
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0072 0.0679 0.0962
Loa Loa (eye worm) hypothetical protein 0.0072 0.0679 0.1081
Mycobacterium ulcerans phenyloxazoline synthase MbtB 0.0031 0.0148 0.0266
Echinococcus granulosus AMP dependent ligase 0.0031 0.0148 0.0175
Entamoeba histolytica hypothetical protein 0.0037 0.0224 1
Trypanosoma brucei beta-ketoacyl-ACP synthase 0.0077 0.0734 1
Loa Loa (eye worm) hypothetical protein 0.0168 0.1908 0.3038
Mycobacterium tuberculosis Probable lipase LipD 0.0072 0.0679 0.0962
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsB 0.0047 0.0353 0.0371
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0057 0.0488 0.0685
Leishmania major acyl carrier protein, putative 0.0031 0.0148 0.1591
Plasmodium falciparum ataxin-2 like protein, putative 0.0076 0.0726 0.9888
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.003 0.0136 0.0136
Onchocerca volvulus 0.0531 0.6553 0.9636
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0062 0.0546 0.0644
Mycobacterium tuberculosis Polyketide synthase Pks12 0.0321 0.3869 0.6741
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0093 0.0945 0.1115
Mycobacterium tuberculosis Conserved protein 0.0092 0.093 0.1417
Entamoeba histolytica hypothetical protein 0.0037 0.0224 1
Onchocerca volvulus 0.0233 0.2736 0.3919
Loa Loa (eye worm) hypothetical protein 0.003 0.0136 0.0217
Echinococcus granulosus NADH dehydrogenase 0.0031 0.0148 0.0175
Schistosoma mansoni hypothetical protein 0.0341 0.4123 0.4866
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsC 0.0321 0.3869 0.6961
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.006 0.0521 0.0675
Mycobacterium ulcerans beta-lactamase 0.0072 0.0679 0.1222
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0072 0.0679 0.0953
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSC 0.0321 0.3869 0.6877
Plasmodium vivax ataxin-2 like protein, putative 0.0076 0.0726 0.9888
Loa Loa (eye worm) hypothetical protein 0.0047 0.0353 0.0561
Trypanosoma brucei Acyl carrier protein, mitochondrial 0.0031 0.0148 0.2016
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0037 0.0224 0.0224
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.003 0.0136 0.0352
Toxoplasma gondii type I fatty acid synthase, putative 0.0217 0.2534 0.655
Loa Loa (eye worm) phosphopantetheine attachment site family protein 0.0031 0.0148 0.0236
Onchocerca volvulus Acyl carrier protein, mitochondrial homolog 0.0031 0.0148 0.0041
Plasmodium falciparum 3-oxoacyl-acyl-carrier protein synthase I/II 0.0077 0.0734 1
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0072 0.0679 0.1222
Echinococcus granulosus geminin 0.0341 0.4123 0.4866
Echinococcus multilocularis cpg binding protein 0.003 0.0142 0.0142
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0136 0.0161
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsE 0.0199 0.2303 0.4143
Mycobacterium ulcerans hypothetical protein 0.0072 0.0679 0.1222
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0093 0.0945 0.0945
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0136 0.0161
Onchocerca volvulus 0.0072 0.0679 0.0837
Mycobacterium ulcerans thioesterase TesA 0.0254 0.3009 0.5413
Brugia malayi AMP-binding enzyme family protein 0.0094 0.0955 0.134
Toxoplasma gondii beta-ketoacyl synthase, N-terminal domain-containing protein 0.0198 0.2288 0.5913
Echinococcus granulosus 3 oxoacyl acyl carrier protein synthase 0.0077 0.0734 0.0866
Brugia malayi hypothetical protein 0.0076 0.0726 0.1019
Brugia malayi beta-lactamase 0.0072 0.0679 0.0953
Mycobacterium tuberculosis Polyketide synthase Pks2 0.0296 0.354 0.6146
Plasmodium vivax 3-oxoacyl-[acyl-carrier-protein] synthase i/ii, putative 0.0077 0.0734 1
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.006 0.0521 0.0521
Mycobacterium tuberculosis Probable polyketide synthase Pks1 0.0219 0.256 0.4369
Brugia malayi Pre-SET motif family protein 0.0205 0.2375 0.3334
Plasmodium vivax hypothetical protein, conserved 0.0044 0.0313 0.4269
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0093 0.0945 0.1326
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0093 0.0945 0.1115
Schistosoma mansoni microtubule-associated protein tau 0.0681 0.8473 1
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsD 0.0302 0.3626 0.6524
Wolbachia endosymbiont of Brugia malayi 3-oxoacyl-ACP synthase 0.0077 0.0734 1
Loa Loa (eye worm) CXXC zinc finger family protein 0.0029 0.0121 0.0192
Schistosoma mansoni acyl carrier protein 0.0031 0.0148 0.0175
Brugia malayi Calcitonin receptor-like protein seb-1 0.0057 0.0488 0.0685
Loa Loa (eye worm) hypothetical protein 0.0076 0.0726 0.1155
Schistosoma mansoni hypothetical protein 0.0341 0.4123 0.4866
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsC 0.0302 0.3626 0.6301
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.003 0.0136 0.0136
Echinococcus multilocularis AMP dependent ligase 0.0031 0.0148 0.0148
Mycobacterium ulcerans polyketide synthase MbtD 0.0094 0.0955 0.1717
Echinococcus multilocularis microtubule associated protein 2 0.0681 0.8473 0.8473
Brugia malayi CXXC zinc finger family protein 0.0029 0.0121 0.0169
Schistosoma mansoni cpg binding protein 0.0029 0.0121 0.0142
Leishmania major hypothetical protein, conserved 0.0092 0.093 1
Loa Loa (eye worm) acyl carrier protein 0.0031 0.0148 0.0236
Mycobacterium ulcerans multifunctional mycocerosic acid synthase membrane-associated Mas 0.0321 0.3869 0.6961
Loa Loa (eye worm) hypothetical protein 0.0121 0.1301 0.2072
Loa Loa (eye worm) hypothetical protein 0.0047 0.0353 0.0561
Schistosoma mansoni transcription factor LCR-F1 0.0037 0.0224 0.0264
Schistosoma mansoni aldehyde dehydrogenase 0.006 0.0521 0.0614
Mycobacterium ulcerans polyketide synthase Pks9 0.0199 0.2303 0.4143
Loa Loa (eye worm) beta-lactamase 0.0072 0.0679 0.1081
Plasmodium vivax acyl carrier protein, putative 0.0031 0.0148 0.2016
Treponema pallidum acyl carrier protein 0.0031 0.0148 0.5
Brugia malayi Phosphopantetheine attachment site family protein 0.0031 0.0148 0.0208
Echinococcus multilocularis 3 oxoacyl (acyl carrier protein) synthase 0.0077 0.0734 0.0734
Trichomonas vaginalis set domain proteins, putative 0.0233 0.2736 1
Mycobacterium leprae Probable lipase LipE 0.0072 0.0679 0.0982
Mycobacterium tuberculosis Probable polyketide synthase Pks17 0.0075 0.0708 0.1014
Plasmodium vivax SET domain protein, putative 0.003 0.0136 0.1858
Mycobacterium tuberculosis Probable thioesterase TesA 0.0254 0.3009 0.5183
Toxoplasma gondii acyl carrier protein ACP 0.0031 0.0148 0.0383
Loa Loa (eye worm) hypothetical protein 0.0121 0.1301 0.2072
Mycobacterium tuberculosis Conserved protein 0.0072 0.0679 0.0962
Trypanosoma cruzi beta-ketoacyl synthase family protein, putative 0.0077 0.0734 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0093 0.0945 0.1115
Toxoplasma gondii type I fatty acid synthase, putative 0.0321 0.3869 1
Onchocerca volvulus Fatty acid synthase homolog 0.055 0.6796 1
Mycobacterium tuberculosis Probable polyketide synthase Pks9 0.0173 0.1974 0.3309
Mycobacterium ulcerans polyketide synthase 0.0321 0.3869 0.6961
Schistosoma mansoni cpg binding protein 0.003 0.0142 0.0167
Plasmodium vivax hypothetical protein, conserved 0.0072 0.0679 0.9253
Loa Loa (eye worm) hypothetical protein 0.051 0.6282 1
Mycobacterium ulcerans non-ribosomal peptide synthetase MbtF 0.0031 0.0148 0.0266
Plasmodium falciparum ataxin-2 like protein, putative 0.0076 0.0726 0.9888
Trypanosoma brucei PAB1-binding protein , putative 0.0076 0.0726 0.9888
Echinococcus granulosus beta LACTamase domain containing family member 0.0072 0.0679 0.0802
Toxoplasma gondii aldehyde dehydrogenase 0.006 0.0521 0.1346
Trypanosoma cruzi PAB1-binding protein , putative 0.0076 0.0726 0.9888
Echinococcus granulosus cpg binding protein 0.003 0.0142 0.0167
Toxoplasma gondii 3-oxoacyl-acyl-carrier protein synthase I/II, putative 0.0077 0.0734 0.1897
Mycobacterium ulcerans 3-oxoacyl-(acyl carrier protein) synthase II 0.0077 0.0734 0.132
Mycobacterium tuberculosis Probable multifunctional mycocerosic acid synthase membrane-associated Mas 0.0321 0.3869 0.6741
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0093 0.0945 0.1115
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0057 0.0488 0.0777
Mycobacterium ulcerans acyl-CoA synthetase 0.0031 0.0148 0.0266
Mycobacterium ulcerans polyketide synthase Pks13 0.0453 0.5558 1
Toxoplasma gondii histone lysine methyltransferase SET1 0.0055 0.0463 0.1196
Trypanosoma cruzi PAB1-binding protein , putative 0.0076 0.0726 0.9888
Brugia malayi hypothetical protein 0.0049 0.0381 0.0535
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSD 0.0302 0.3626 0.6429
Mycobacterium leprae Probable multifunctional mycocerosic acid synthase membrane associated enzyme Mas 0.0321 0.3869 0.6877
Onchocerca volvulus Huntingtin homolog 0.0121 0.1301 0.1769
Brugia malayi Pre-SET motif family protein 0.003 0.0136 0.0191
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsA 0.0243 0.2863 0.5151
Brugia malayi hypothetical protein 0.0037 0.0224 0.0314
Mycobacterium tuberculosis Probable polyketide synthase Pks15 0.0123 0.1333 0.2147
Onchocerca volvulus 0.0072 0.0679 0.0837
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.006 0.0521 0.0614
Loa Loa (eye worm) hypothetical protein 0.0072 0.0679 0.1081
Onchocerca volvulus 0.0285 0.3403 0.4918
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0031 0.0148 0.0208
Trypanosoma brucei hypothetical protein, conserved 0.0072 0.0679 0.9253
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsD 0.0302 0.3626 0.6301
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0072 0.0679 0.0962
Brugia malayi hypothetical protein 0.0121 0.1301 0.1827
Echinococcus multilocularis NADH dehydrogenase 0.0031 0.0148 0.0148
Mycobacterium leprae Probable polyketide synthase Pks1 0.0321 0.3869 0.6877
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0093 0.0945 0.1504
Mycobacterium tuberculosis Hypothetical protein 0.0092 0.093 0.1417
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.0521 0.0937
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSB 0.0243 0.2863 0.5018
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.0521 0.0937
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0093 0.0945 0.0945
Trypanosoma cruzi Acyl carrier protein, mitochondrial, putative 0.0031 0.0148 0.2016
Mycobacterium ulcerans Type I modular polyketide synthase 0.0302 0.3626 0.6524
Toxoplasma gondii LsmAD domain-containing protein 0.0076 0.0726 0.1876
Schistosoma mansoni hypothetical protein 0.0031 0.0148 0.0175
Echinococcus multilocularis beta LACTamase domain containing family member 0.0072 0.0679 0.0679
Mycobacterium leprae conserved hypothetical protein 0.0072 0.0679 0.0982
Schistosoma mansoni hypothetical protein 0.0034 0.019 0.0224
Mycobacterium tuberculosis Phenyloxazoline synthase MbtB (phenyloxazoline synthetase) 0.0285 0.3403 0.5898
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0136 0.0161
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0072 0.0679 0.0802
Chlamydia trachomatis acyl carrier protein 0.0031 0.0148 0.2016
Wolbachia endosymbiont of Brugia malayi acyl carrier protein 0.0031 0.0148 0.2016
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.006 0.0521 0.5597
Mycobacterium tuberculosis Conserved protein 0.0072 0.0679 0.0962

Activities

Activity type Activity value Assay description Source Reference
Change (functional) = 456 % Inactivation processes of human heart Na channel expressed in Xenopus oocytes as increase in current at 10 uM ChEMBL. 7629798
dP/dt (functional) = 22 nM Concentration of the compound which increased contractility by 20% in rabbit ChEMBL. 7629798
EC20 (functional) = 57 nM Antiarrhythmic activity was determined by measuring the concentration of the compound that produced a 20 ms increase in ERP ChEMBL. 7629798
EC50 (functional) = 447 nM Effective concentration against Xenopus oocytes expressing human heart Na channel ChEMBL. 7629798

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

1 literature reference was collected for this gene.

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