Detailed information for compound 577390

Basic information

Technical information
  • TDR Targets ID: 577390
  • Name: 2'-Glutaryltaxol-3-(dimethylamino)propylamide
  • MW: 1088.63 | Formula: C57H70ClN3O16
  • H donors: 4 H acceptors: 10 LogP: 4.62 Rotable bonds: 26
    Rule of 5 violations (Lipinski): 2
  • SMILES: CN(CCCNC(=O)CCCC(=O)OC(C(c1ccccc1)NC(=O)c1ccccc1)C(=O)O[C@H]1C[C@@]2(O)C(OC(=O)c3ccccc3)C3[C@@](C(=O)[C@@H](C(=C1C)C2(C)C)OC(=O)C)(C)[C@@H](O)CC1C3(CO1)OC(=O)C)C.Cl
  • InChi: 1S/C57H69N3O16.ClH/c1-33-39(73-53(69)47(74-43(65)27-18-26-42(64)58-28-19-29-60(7)8)45(36-20-12-9-13-21-36)59-51(67)37-22-14-10-15-23-37)31-57(70)50(75-52(68)38-24-16-11-17-25-38)48-55(6,40(63)30-41-56(48,32-71-41)76-35(3)62)49(66)46(72-34(2)61)44(33)54(57,4)5;/h9-17,20-25,39-41,45-48,50,63,70H,18-19,26-32H2,1-8H3,(H,58,64)(H,59,67);1H/t39-,40-,41?,45?,46+,47?,48?,50?,55+,56?,57+;/m0./s1
  • InChiKey: ZMYCRVJILUQQGH-QHKUZATPSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • Benzenepropanoic acid, .beta.-(benzoylamino)-.alpha.- [[5-[[3-(dimethylamino)propyl]amino]-1,5-dioxopentyl]oxy]-, 6,12b-bis(acetyloxy)-12-(benzoyloxy)- 2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-4,11-dihydroxy- 4a,8,13,13-tetramethyl-5-oxo-7,11-methano-1H-cyclodeca[3,4] benz[1,2-b]oxet-9-yl ester, [2aR-[2a.alpha.,4.beta.,4a.beta.,6.beta.,9.alpha.(.alpha.R*, .beta.S*),11.alpha.,12.alpha.,12a.alpha.,12b.alpha.]]-
  • NSC608832
  • TAXOL, 2'-N-[3-(DIMETHYLAMINO)PROPYL]GLUTARAMATE

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
Echinococcus multilocularis C type lectin domian containing protein 0.0038 0.0018 0.0018
Onchocerca volvulus 0.0095 0.0124 0.0748
Trichomonas vaginalis CAMK family protein kinase 0.0054 0.0048 0.0068
Loa Loa (eye worm) hypothetical protein 0.0912 0.1638 0.1636
Toxoplasma gondii rhoptry neck protein RON1 0.0038 0.0018 0.0016
Echinococcus granulosus diacylglycerol O acyltransferase 1 0.5427 1 1
Trichomonas vaginalis porcupine, putative 0.0912 0.1638 0.2301
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0047 0.0035 0.0049
Brugia malayi Hhat protein 0.0912 0.1638 0.1636
Mycobacterium ulcerans acyl-CoA synthetase 0.0099 0.0131 1
Leishmania major hypothetical protein, conserved 0.0243 0.0399 0.056
Trypanosoma brucei importin beta-1 subunit, putative 0.0033 0.0009 0.001
Trichomonas vaginalis CMGC family protein kinase 0.006 0.006 0.0084
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0912 0.1638 0.2299
Entamoeba histolytica hypothetical protein 0.0072 0.0081 0.0111
Brugia malayi hypothetical protein 0.0038 0.0018 0.0016
Trypanosoma cruzi glycerol uptake protein, putative 0.0912 0.1638 0.2301
Loa Loa (eye worm) hypothetical protein 0.0038 0.0018 0.0016
Onchocerca volvulus Arrow homolog 0.0054 0.0048 0.028
Schistosoma mansoni hypothetical protein 0.0166 0.0255 0.0253
Trypanosoma brucei DNA repair and recombination helicase protein PIF7 0.3871 0.7117 1
Plasmodium falciparum apical sushi protein 0.0038 0.0018 0.0016
Entamoeba histolytica acetyltransferase, GNAT family 0.0043 0.0028 0.0037
Echinococcus granulosus Protein patched homolog 1 0.0084 0.0104 0.0104
Entamoeba histolytica serine/threonine protein kinase, putative 0.0109 0.0149 0.0207
Loa Loa (eye worm) hypothetical protein 0.0107 0.0147 0.0145
Loa Loa (eye worm) RNA binding protein 0.0128 0.0185 0.0183
Mycobacterium ulcerans acyl-CoA synthetase 0.0099 0.0131 1
Mycobacterium ulcerans peptide synthetase Nrp (peptide synthase) 0.0029 0.0002 0.0143
Schistosoma mansoni tar DNA-binding protein 0.0128 0.0185 0.0183
Loa Loa (eye worm) hypothetical protein 0.0038 0.0019 0.0017
Onchocerca volvulus 0.0038 0.0018 0.01
Giardia lamblia Kinase, CMGC MAPK 0.006 0.006 0.0045
Entamoeba histolytica acyl-CoA synthetase, putative 0.0099 0.0131 0.0182
Schistosoma mansoni subfamily M12A unassigned peptidase (M12 family) 0.007 0.0077 0.0075
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.006 0.006 0.0084
Loa Loa (eye worm) DEAH box polypeptide 35 0.0038 0.0019 0.0017
Mycobacterium tuberculosis Possible fatty-acid-CoA ligase FadD10 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0029 0.0002 0.0143
Entamoeba histolytica acyl-coA synthetase, putative 0.0099 0.0131 0.0182
Entamoeba histolytica hypothetical protein, conserved 0.0912 0.1638 0.2299
Loa Loa (eye worm) low-density lipoprotein receptor repeat class B containing protein 0.0054 0.0048 0.0046
Brugia malayi Low-density lipoprotein receptor repeat class B containing protein 0.0054 0.0048 0.0046
Trypanosoma brucei hypothetical protein, conserved 0.0243 0.0399 0.0558
Echinococcus multilocularis fibrillin 1 0.0054 0.0048 0.0048
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0912 0.1638 0.1636
Trypanosoma cruzi polo-like protein kinase, putative 0.0109 0.0149 0.021
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0099 0.0131 1
Brugia malayi Sushi domain 0.0038 0.0018 0.0016
Onchocerca volvulus 0.0038 0.0018 0.01
Schistosoma mansoni hypothetical protein 0.0081 0.0098 0.0096
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0029 0.0002 0.0143
Entamoeba histolytica hypothetical protein 0.0072 0.0081 0.0111
Loa Loa (eye worm) hypothetical protein 0.0099 0.0131 0.0129
Onchocerca volvulus Serine\/threonine kinase homolog 0.0109 0.0149 0.0901
Echinococcus multilocularis L aminoadipate semialdehyde 0.0095 0.0124 0.0124
Echinococcus multilocularis protein cysteine N palmitoyltransferase 0.0912 0.1638 0.1638
Schistosoma mansoni membrane-bound acyltransferase/hhat 0.0912 0.1638 0.1636
Loa Loa (eye worm) hypothetical protein 0.007 0.0077 0.0075
Loa Loa (eye worm) hhat protein 0.0912 0.1638 0.1636
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0199 0.0316 0.0315
Mycobacterium ulcerans phenyloxazoline synthase MbtB 0.0029 0.0002 0.0143
Brugia malayi aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase 0.0095 0.0124 0.0122
Trichomonas vaginalis conserved hypothetical protein 0.0084 0.0104 0.0146
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0038 0.0019 0.0017
Loa Loa (eye worm) hypothetical protein 0.0099 0.0131 0.0129
Trichomonas vaginalis CAMK family protein kinase 0.0109 0.0149 0.021
Loa Loa (eye worm) bone morphogenetic protein 1b 0.007 0.0077 0.0075
Echinococcus granulosus o acyltransferase membrane bound domain 0.0912 0.1638 0.1638
Trichomonas vaginalis CAMK family protein kinase 0.0109 0.0149 0.021
Loa Loa (eye worm) membrane bound O-acyltransferase domain containing 1 0.0912 0.1638 0.1636
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.006 0.006 0.0058
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.0196 0.0311 0.0434
Echinococcus multilocularis diacylglycerol O acyltransferase 1 0.5427 1 1
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0099 0.0131 1
Leishmania major acetyl-CoA synthetase, putative 0.0029 0.0002 0.0003
Toxoplasma gondii acyl-CoA:diacylglycerol acyltransferase 1-related enzyme 0.5427 1 1
Leishmania major acetyl-CoA synthetase, putative 0.0029 0.0002 0.0003
Brugia malayi Fibulin-1 precursor 0.0054 0.0048 0.0046
Trypanosoma brucei glycerol uptake protein, putative 0.0912 0.1638 0.2299
Loa Loa (eye worm) pregnancy-associated plasma protein-E 0.0038 0.0018 0.0016
Entamoeba histolytica hypothetical protein 0.0912 0.1638 0.2299
Mycobacterium ulcerans non-ribosomal peptide synthetase MbtF 0.0029 0.0002 0.0143
Echinococcus granulosus importin subunit beta 1 0.0033 0.0009 0.0009
Brugia malayi Calcium binding EGF domain containing protein 0.0054 0.0048 0.0046
Brugia malayi GCC2 and GCC3 family protein 0.0038 0.0018 0.0016
Brugia malayi TAR-binding protein 0.0128 0.0185 0.0183
Trypanosoma brucei importin beta-1 subunit, putative 0.0033 0.0009 0.001
Leishmania major PIF1 helicase-like protein, putative,DNA repair and recombination protein, mitochondrial precursor, putative 0.3871 0.7117 1
Loa Loa (eye worm) hypothetical protein 0.0038 0.0018 0.0016
Toxoplasma gondii hypothetical protein 0.0912 0.1638 0.1636
Echinococcus multilocularis laminin 0.0054 0.0048 0.0048
Loa Loa (eye worm) hypothetical protein 0.0054 0.0048 0.0046
Loa Loa (eye worm) MBOAT family protein 0.0912 0.1638 0.1636
Onchocerca volvulus 0.0912 0.1638 1
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.007 0.0077 0.5903
Echinococcus granulosus mitogen activated protein kinase 0.006 0.006 0.006
Loa Loa (eye worm) hypothetical protein 0.0074 0.0085 0.0083
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0099 0.0131 1
Onchocerca volvulus 0.0038 0.0018 0.01
Echinococcus multilocularis lysophospholipid acyltransferase 7 0.0912 0.1638 0.1638
Echinococcus multilocularis snurportin 1 0.0352 0.06 0.06
Schistosoma mansoni importin beta-1 0.0033 0.0009 0.0007
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0912 0.1638 0.1638
Brugia malayi RNA recognition motif domain containing protein 0.0128 0.0185 0.0183
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0109 0.0149 0.0149
Trypanosoma cruzi hypothetical protein, conserved 0.0243 0.0399 0.056
Trypanosoma cruzi polo-like protein kinase, putative 0.0109 0.0149 0.021
Trypanosoma brucei polo-like protein kinase 0.0109 0.0149 0.0207
Echinococcus granulosus Niemann Pick C1 protein 0.028 0.0466 0.0466
Trichomonas vaginalis CMGC family protein kinase 0.006 0.006 0.0084
Loa Loa (eye worm) hypothetical protein 0.0038 0.0018 0.0016
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.006 0.006 0.0084
Brugia malayi hypothetical protein 0.0038 0.0018 0.0016
Trichomonas vaginalis bromodomain-containing protein, putative 0.0047 0.0035 0.0049
Schistosoma mansoni kinase 0.0055 0.0051 0.0049
Echinococcus granulosus tar DNA binding protein 0.0128 0.0185 0.0185
Trichomonas vaginalis conserved hypothetical protein 0.0912 0.1638 0.2301
Schistosoma mansoni hypothetical protein 0.0081 0.0098 0.0096
Brugia malayi serine/threonine-protein kinase plk-2 0.0109 0.0149 0.0147
Loa Loa (eye worm) hypothetical protein 0.0084 0.0104 0.0102
Trypanosoma cruzi hypothetical protein, conserved 0.0243 0.0399 0.056
Onchocerca volvulus 0.0038 0.0018 0.01
Brugia malayi MAP kinase sur-1 0.006 0.006 0.0058
Echinococcus granulosus sterol O acyltransferase 1 0.0912 0.1638 0.1638
Plasmodium vivax importin-beta 2, putative 0.0033 0.0009 0.0007
Trypanosoma cruzi glycerol uptake protein, putative 0.0912 0.1638 0.2301
Brugia malayi AMP-binding enzyme family protein 0.0099 0.0131 0.0129
Brugia malayi MBOAT family protein 0.0912 0.1638 0.1636
Leishmania major glycerol uptake protein, putative 0.0912 0.1638 0.2301
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.006 0.006 0.0084
Toxoplasma gondii calcium binding egf domain-containing protein 0.0054 0.0048 0.0046
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0084 0.0104 0.0102
Brugia malayi MBOAT family protein 0.0912 0.1638 0.1636
Loa Loa (eye worm) cytochrome P450 family protein 0.0045 0.0031 0.0029
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0099 0.0131 1
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0099 0.0131 1
Trichomonas vaginalis CAMK family protein kinase 0.0109 0.0149 0.021
Toxoplasma gondii rhoptry neck protein RON9 0.0038 0.0018 0.0016
Trichomonas vaginalis CAMK family protein kinase 0.0109 0.0149 0.021
Brugia malayi Cytochrome P450 family protein 0.0045 0.0031 0.0029
Trichomonas vaginalis CAMK family protein kinase 0.0054 0.0048 0.0068
Brugia malayi RNA, U transporter 1 0.0094 0.0122 0.012
Loa Loa (eye worm) hypothetical protein 0.0196 0.0311 0.0309
Entamoeba histolytica hypothetical protein 0.0072 0.0081 0.0111
Schistosoma mansoni aminoadipate-semialdehyde dehydrogenase 0.0095 0.0124 0.0122
Echinococcus multilocularis Tolloid protein 1 0.007 0.0077 0.0077
Echinococcus granulosus o acyltransferase membrane bound domain 0.0912 0.1638 0.1638
Loa Loa (eye worm) hypothetical protein 0.0103 0.0139 0.0137
Trichomonas vaginalis CMGC family protein kinase 0.006 0.006 0.0084
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.016 0.0244 0.0244
Echinococcus granulosus Membrane bound O acyl transferase MBOAT 0.0912 0.1638 0.1638
Trypanosoma cruzi acetyl-CoA synthetase, putative 0.0029 0.0002 0.0003
Trypanosoma cruzi DNA repair and recombination helicase protein PIF7, putative 0.3871 0.7117 1
Loa Loa (eye worm) hypothetical protein 0.0912 0.1638 0.1636
Echinococcus multilocularis tar DNA binding protein 0.0128 0.0185 0.0185
Schistosoma mansoni tar DNA-binding protein 0.0128 0.0185 0.0183
Echinococcus multilocularis sterol regulatory element binding protein 0.0084 0.0104 0.0104
Mycobacterium ulcerans acyl-CoA synthetase 0.0029 0.0002 0.0143
Onchocerca volvulus 0.0038 0.0018 0.01
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0912 0.1638 0.1636
Mycobacterium tuberculosis P-hydroxybenzoyl-AMP ligase FadD22 0.0029 0.0002 0.0143
Brugia malayi RNA binding protein 0.0128 0.0185 0.0183
Onchocerca volvulus 0.0038 0.0018 0.01
Brugia malayi AMP-binding enzyme family protein 0.0099 0.0131 0.0129
Plasmodium vivax apical sushi protein, putative 0.0038 0.0018 0.0016
Loa Loa (eye worm) TAR-binding protein 0.0128 0.0185 0.0183
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0912 0.1638 0.2299
Mycobacterium ulcerans hypothetical protein 0.0099 0.0131 1
Trypanosoma cruzi acetyl-CoA synthetase, putative 0.0029 0.0002 0.0003
Mycobacterium ulcerans non-ribosomal peptide synthetase MbtE 0.0029 0.0002 0.0143
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0074 0.0085 0.5
Echinococcus granulosus membrane bound acyltransferase:hhat 0.0912 0.1638 0.1638
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0912 0.1638 0.2299
Mycobacterium tuberculosis Peptide synthetase MbtF (peptide synthase) 0.0029 0.0002 0.0143
Leishmania major 4-coumarate:coa ligase-like protein 0.0099 0.0131 0.0184
Plasmodium falciparum acyl-CoA synthetase 0.0074 0.0085 0.0083
Leishmania major glycerol uptake protein, putative 0.0912 0.1638 0.2301
Trypanosoma cruzi long-chain-fatty-acid-CoA ligase, putative 0.0029 0.0002 0.0003
Brugia malayi acetyltransferase, GNAT family protein 0.016 0.0244 0.0242
Trichomonas vaginalis conserved hypothetical protein 0.0912 0.1638 0.2301
Schistosoma mansoni hypothetical protein 0.0081 0.0098 0.0096
Giardia lamblia Kinase, PLK 0.0109 0.0149 0.0171
Schistosoma mansoni hypothetical protein 0.0081 0.0098 0.0096
Echinococcus granulosus mitogen activated protein kinase 3 0.006 0.006 0.006
Loa Loa (eye worm) hypothetical protein 0.0054 0.0048 0.0046
Loa Loa (eye worm) hypothetical protein 0.0074 0.0085 0.0083
Plasmodium vivax diacylglycerol O-acyltransferase, putative 0.5427 1 1
Trichomonas vaginalis CMGC family protein kinase 0.006 0.006 0.0084
Trypanosoma cruzi GUP1, putative 0.0912 0.1638 0.2301
Echinococcus multilocularis protein patched 0.0084 0.0104 0.0104
Echinococcus multilocularis c4b binding protein beta chain 0.0038 0.0018 0.0018
Schistosoma mansoni sterol O-acyltransferase 1 0.0912 0.1638 0.1636
Entamoeba histolytica vacuolar protein sorting 26 0.0912 0.1638 0.2299
Echinococcus granulosus acetyl coenzyme A synthetase cytoplasmic 0.0029 0.0002 0.0002
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.016 0.0244 0.0242
Schistosoma mansoni zinc finger protein 0.0912 0.1638 0.1636
Mycobacterium tuberculosis Fatty-acid-CoA synthetase FadD17 (fatty-acid-CoA synthase) (fatty-acid-CoA ligase) 0.0029 0.0002 0.0143
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0047 0.0035 0.0033
Schistosoma mansoni egf-like domain protein 0.0054 0.0048 0.0046
Trypanosoma cruzi long-chain-fatty-acid-CoA ligase, putative 0.0029 0.0002 0.0003
Mycobacterium tuberculosis Phenyloxazoline synthase MbtB (phenyloxazoline synthetase) 0.0029 0.0002 0.0143
Trichomonas vaginalis transmembrane protein nessy, putative 0.0912 0.1638 0.2301
Mycobacterium tuberculosis Probable medium chain fatty-acid-CoA ligase FadD14 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0029 0.0002 0.0143
Schistosoma mansoni leukocyte receptor cluster (lrc) member 4 protein 0.0912 0.1638 0.1636
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0047 0.0035 0.0033
Echinococcus multilocularis Niemann Pick C1 protein 0.028 0.0466 0.0466
Brugia malayi MBOAT family protein 0.0912 0.1638 0.1636
Echinococcus granulosus L aminoadipate semialdehyde 0.0095 0.0124 0.0124
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.007 0.0077 0.5903
Trypanosoma cruzi GUP1, putative 0.0912 0.1638 0.2301
Onchocerca volvulus 0.0038 0.0018 0.01
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0099 0.0131 1
Loa Loa (eye worm) hypothetical protein 0.4515 0.831 0.831
Loa Loa (eye worm) MBOAT family protein 0.0912 0.1638 0.1636
Loa Loa (eye worm) hypothetical protein 0.0038 0.0018 0.0016
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.006 0.006 0.0081
Brugia malayi AMP-binding enzyme family protein 0.0099 0.0131 0.0129
Plasmodium vivax acyl-CoA synthetase, putative 0.0074 0.0085 0.0083
Echinococcus multilocularis Niemann Pick C1 protein 0.0196 0.0311 0.0311
Trypanosoma cruzi DNA repair and recombination helicase protein PIF6, putative 0.3871 0.7117 1
Schistosoma mansoni serine/threonine protein kinase 0.006 0.006 0.0058
Toxoplasma gondii HEAT repeat-containing protein 0.0033 0.0009 0.0007
Mycobacterium ulcerans acyl-CoA synthetase 0.0029 0.0002 0.0143
Mycobacterium ulcerans bifunctional enzyme MbtA: salicyl-AMP ligase (SAL-AMP ligase) + salicyl-S-ACP synthetase 0.0029 0.0002 0.0143
Echinococcus granulosus C type lectin domian containing protein 0.0038 0.0018 0.0018
Onchocerca volvulus 0.0038 0.0018 0.01
Loa Loa (eye worm) hypothetical protein 0.0912 0.1638 0.1636
Trichomonas vaginalis antibiotic synthetase, putative 0.0029 0.0002 0.0003
Trichomonas vaginalis antibiotic synthetase, putative 0.0029 0.0002 0.0003
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD8 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0029 0.0002 0.0143
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0912 0.1638 0.1638
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0109 0.0149 0.0147
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0074 0.0085 0.6472
Loa Loa (eye worm) diacylglycerol acyltransferase 0.5427 1 1
Loa Loa (eye worm) hypothetical protein 0.0054 0.0048 0.0046
Entamoeba histolytica hypothetical protein 0.0072 0.0081 0.0111
Mycobacterium ulcerans acyl-CoA synthetase 0.0029 0.0002 0.0143
Brugia malayi hypothetical protein 0.0038 0.0018 0.0016
Treponema pallidum alginate O-acetylation protein (algI) 0.0912 0.1638 0.5
Leishmania major glycerol uptake protein, putative 0.0912 0.1638 0.2301
Echinococcus granulosus ATP dependent DNA helicase PIF1 0.3871 0.7117 0.7117
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0912 0.1638 0.1636
Schistosoma mansoni c4b-binding protein beta chain 0.0038 0.0018 0.0016
Trypanosoma brucei protein kinase, putative 0.006 0.006 0.0081
Entamoeba histolytica DNA repair and recombination protein, putative 0.3871 0.7117 1
Leishmania major hypothetical protein, conserved 0.0912 0.1638 0.2301
Entamoeba histolytica acyl-CoA synthetase, putative 0.0099 0.0131 0.0182
Echinococcus multilocularis sterol O acyltransferase 1 0.0912 0.1638 0.1638
Brugia malayi MBOAT family protein 0.0912 0.1638 0.1636
Trypanosoma cruzi glycerol uptake protein, putative 0.0912 0.1638 0.2301
Mycobacterium tuberculosis Probable peptide synthetase Nrp (peptide synthase) 0.0029 0.0002 0.0143
Leishmania major glycerol uptake protein, putative 0.0912 0.1638 0.2301
Toxoplasma gondii acyl-CoA:cholesterol acyltransferase alpha ACAT1-alpha 0.5427 1 1
Mycobacterium ulcerans acyl-CoA synthetase 0.0029 0.0002 0.0143
Brugia malayi Probable ATP-dependent helicase DHX35 0.0038 0.0019 0.0017
Trichomonas vaginalis CAMK family protein kinase 0.0109 0.0149 0.021
Loa Loa (eye worm) hypothetical protein 0.0099 0.0131 0.0129
Echinococcus granulosus expressed conserved protein 0.0184 0.0289 0.0289
Echinococcus granulosus histone acetyltransferase KAT2B 0.0047 0.0035 0.0035
Echinococcus granulosus c4b binding protein beta chain 0.0038 0.0018 0.0018
Mycobacterium ulcerans acyl-CoA synthetase 0.0029 0.0002 0.0143
Loa Loa (eye worm) multiple epidermal growth factor-like domains 6 0.0054 0.0048 0.0046
Echinococcus granulosus Niemann Pick C1 protein 0.0196 0.0311 0.0311
Leishmania major 4-coumarate:coa ligase-like protein 0.0099 0.0131 0.0184
Echinococcus granulosus geminin 0.0166 0.0255 0.0255
Echinococcus granulosus sterol regulatory element binding protein 0.0084 0.0104 0.0104
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0128 0.0185 0.0183
Leishmania major PIF1 helicase-like protein, putative,DNA repair and recombination protein, mitochondrial precursor, putative 0.3871 0.7117 1
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0038 0.0019 0.0017
Trypanosoma brucei glycerol uptake protein, putative 0.0912 0.1638 0.2299
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0109 0.0149 0.0149
Loa Loa (eye worm) hypothetical protein 0.0038 0.0018 0.0016
Echinococcus multilocularis acetyl coenzyme A synthetase, cytoplasmic 0.0029 0.0002 0.0002
Echinococcus granulosus protein cysteine N palmitoyltransferase 0.0912 0.1638 0.1638
Plasmodium falciparum diacylglycerol O-acyltransferase 0.5427 1 1
Toxoplasma gondii calcium binding egf domain-containing protein 0.0054 0.0048 0.0046
Trichomonas vaginalis CAMK family protein kinase 0.0109 0.0149 0.021
Brugia malayi hypothetical protein 0.0038 0.0018 0.0016
Trypanosoma cruzi DNA repair and recombination helicase protein PIF7, putative 0.3871 0.7117 1
Echinococcus granulosus laminin 0.0054 0.0048 0.0048
Brugia malayi Importin beta-1 subunit 0.0033 0.0009 0.0007
Schistosoma mansoni hypothetical protein 0.0072 0.0081 0.0079
Schistosoma mansoni serine/threonine protein kinase 0.0109 0.0149 0.0147
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.006 0.006 0.0084
Loa Loa (eye worm) hypothetical protein 0.0912 0.1638 0.1636
Mycobacterium ulcerans acyl-CoA synthetase 0.0029 0.0002 0.0143
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0072 0.0081 0.0081
Mycobacterium tuberculosis Bifunctional enzyme MbtA: salicyl-AMP ligase (SAL-AMP ligase) + salicyl-S-ArCP synthetase 0.0029 0.0002 0.0143
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0074 0.0085 0.6472
Schistosoma mansoni hypothetical protein 0.3871 0.7117 0.7116
Loa Loa (eye worm) hypothetical protein 0.0074 0.0085 0.0083
Loa Loa (eye worm) hypothetical protein 0.0038 0.0018 0.0016
Echinococcus multilocularis expressed conserved protein 0.0184 0.0289 0.0289
Echinococcus granulosus snurportin 1 0.0352 0.06 0.06
Echinococcus multilocularis membrane bound acyltransferase:hhat 0.0912 0.1638 0.1638
Trichomonas vaginalis conserved hypothetical protein 0.3871 0.7117 1
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0047 0.0035 0.0033
Plasmodium falciparum importin beta, putative 0.0033 0.0009 0.0007
Echinococcus granulosus o acyltransferase membrane bound domain 0.0912 0.1638 0.1638
Brugia malayi hypothetical protein 0.0038 0.0018 0.0016
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0099 0.0131 1
Leishmania major long-chain-fatty-acid-CoA ligase, putative 0.0029 0.0002 0.0003
Brugia malayi hypothetical protein 0.0072 0.0081 0.0079
Schistosoma mansoni patched 1 0.0084 0.0104 0.0102
Loa Loa (eye worm) acetyltransferase 0.016 0.0244 0.0242
Trypanosoma brucei DNA repair and recombination helicase protein PIF6 0.3871 0.7117 1
Loa Loa (eye worm) hypothetical protein 0.0074 0.0085 0.0083
Schistosoma mansoni tar DNA-binding protein 0.0128 0.0185 0.0183
Schistosoma mansoni hypothetical protein 0.0352 0.06 0.0598
Brugia malayi hypothetical protein 0.0038 0.0018 0.0016
Brugia malayi Niemann-Pick C1 protein precursor 0.0196 0.0311 0.0309
Echinococcus multilocularis geminin 0.0166 0.0255 0.0255
Trichomonas vaginalis CAMK family protein kinase 0.0109 0.0149 0.021
Schistosoma mansoni hypothetical protein 0.0166 0.0255 0.0253
Echinococcus granulosus Tolloid protein 1 0.007 0.0077 0.0077
Loa Loa (eye worm) hypothetical protein 0.0038 0.0018 0.0016
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0352 0.06 0.0598
Schistosoma mansoni transcription factor LCR-F1 0.0072 0.0081 0.0079
Loa Loa (eye worm) hypothetical protein 0.0095 0.0124 0.0122
Onchocerca volvulus 0.0038 0.0018 0.01
Mycobacterium ulcerans long-chain-acyl-CoA synthetase 0.0029 0.0002 0.0143
Echinococcus multilocularis importin subunit beta 1 0.0033 0.0009 0.0009
Loa Loa (eye worm) MBOAT family protein 0.0912 0.1638 0.1636
Echinococcus granulosus lysophospholipid acyltransferase 7 0.0912 0.1638 0.1638
Entamoeba histolytica hypothetical protein, conserved 0.3871 0.7117 1
Plasmodium falciparum histone acetyltransferase GCN5 0.0043 0.0028 0.0026
Schistosoma mansoni tar DNA-binding protein 0.0128 0.0185 0.0183
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0099 0.0131 1
Mycobacterium tuberculosis Possible fatty-acid-CoA ligase FadD1 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0029 0.0002 0.0143
Echinococcus granulosus histone acetyltransferase KAT2B 0.0155 0.0236 0.0236
Schistosoma mansoni tar DNA-binding protein 0.0128 0.0185 0.0183
Echinococcus multilocularis ATP dependent DNA helicase PIF1 0.3871 0.7117 0.7117
Trichomonas vaginalis conserved hypothetical protein 0.0912 0.1638 0.2301
Brugia malayi pregnancy-associated plasma protein-A 0.0038 0.0018 0.0016
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0072 0.0081 0.0081
Schistosoma mansoni diacylglycerol O-acyltransferase 1 0.5427 1 1
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.006 0.006 0.0084
Leishmania major glycerol uptake protein, putative 0.0912 0.1638 0.2301
Onchocerca volvulus 0.0038 0.0018 0.01
Echinococcus multilocularis Membrane bound O acyl transferase, MBOAT 0.0912 0.1638 0.1638
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0109 0.0149 0.021
Giardia lamblia Rrm3p helicase 0.3871 0.7117 1
Onchocerca volvulus 0.0099 0.0131 0.0791
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.007 0.0077 0.5903
Leishmania major 4-coumarate:coa ligase-like protein 0.0099 0.0131 0.0184
Mycobacterium ulcerans acetyl-CoA synthetase 0.0029 0.0002 0.0143
Echinococcus multilocularis mitogen activated protein kinase 0.006 0.006 0.006
Mycobacterium ulcerans acyl-CoA synthetase 0.0029 0.0002 0.0143
Loa Loa (eye worm) hhat protein 0.0912 0.1638 0.1636
Loa Loa (eye worm) hypothetical protein 0.0038 0.0018 0.0016
Mycobacterium tuberculosis Peptide synthetase MbtE (peptide synthase) 0.0029 0.0002 0.0143
Echinococcus multilocularis mitogen activated protein kinase 3 0.006 0.006 0.006
Brugia malayi MBOAT family protein 0.0912 0.1638 0.1636
Brugia malayi CHE-14 protein 0.0084 0.0104 0.0102
Schistosoma mansoni hypothetical protein 0.0912 0.1638 0.1636
Echinococcus multilocularis protein dispatched 1 0.0096 0.0126 0.0126
Mycobacterium ulcerans acyl-CoA synthetase 0.0099 0.0131 1
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.006 0.006 0.0084
Loa Loa (eye worm) hypothetical protein 0.0033 0.0009 0.0007
Mycobacterium ulcerans O-succinylbenzoic acid--CoA ligase 0.0029 0.0002 0.0143
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.006 0.006 0.0058
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.007 0.0077 0.5903
Brugia malayi hypothetical protein 0.0038 0.0018 0.0016
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.254 0.4652 0.4652
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0912 0.1638 0.1638
Mycobacterium ulcerans acyl-CoA synthetase 0.0029 0.0002 0.0143
Loa Loa (eye worm) hypothetical protein 0.0074 0.0085 0.0083

Activities

No activities found for this compound.

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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