Detailed information for compound 1121641

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 446.422 | Formula: C22H21F3N4O3
  • H donors: 2 H acceptors: 3 LogP: 3.4 Rotable bonds: 11
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOc1cccc(c1)C(=O)NCCNC(=O)c1cn(nc1C(F)(F)F)c1ccccc1
  • InChi: 1S/C22H21F3N4O3/c1-2-32-17-10-6-7-15(13-17)20(30)26-11-12-27-21(31)18-14-29(16-8-4-3-5-9-16)28-19(18)22(23,24)25/h3-10,13-14H,2,11-12H2,1H3,(H,26,30)(H,27,31)
  • InChiKey: GDQGNDISNUUYPE-UHFFFAOYSA-N  


Substructure search Similarity search

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 diacylglycerol O-acyltransferase 1 Starlite/ChEMBL References
Mus musculus diacylglycerol O-acyltransferase 1 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Plasmodium yoelii acyl transferase-related Get druggable targets OG5_128200 All targets in OG5_128200
Cryptosporidium hominis acyl-CoA:diacylglycerol acyltransferase 1-related enzyme Get druggable targets OG5_128200 All targets in OG5_128200
Plasmodium knowlesi diacylglycerol O-acyltransferase, putative Get druggable targets OG5_128200 All targets in OG5_128200
Loa Loa (eye worm) diacylglycerol acyltransferase Get druggable targets OG5_128200 All targets in OG5_128200
Plasmodium falciparum diacylglycerol O-acyltransferase Get druggable targets OG5_128200 All targets in OG5_128200
Cryptosporidium parvum diacylglycerol acyltransferase 1 Get druggable targets OG5_128200 All targets in OG5_128200
Toxoplasma gondii acyl-CoA:cholesterol acyltransferase alpha ACAT1-alpha Get druggable targets OG5_128200 All targets in OG5_128200
Plasmodium berghei diacylglycerol O-acyltransferase, putative Get druggable targets OG5_128200 All targets in OG5_128200
Toxoplasma gondii acyl-CoA:diacylglycerol acyltransferase 1-related enzyme Get druggable targets OG5_128200 All targets in OG5_128200
Candida albicans Acyl-CoA cholesterol acyltransferase Get druggable targets OG5_128200 All targets in OG5_128200
Theileria parva diacylglycerol O-acyltransferase, putative Get druggable targets OG5_128200 All targets in OG5_128200
Candida albicans Acyl-CoA cholesterol acyltransferase Get druggable targets OG5_128200 All targets in OG5_128200
Echinococcus multilocularis diacylglycerol O acyltransferase 1 Get druggable targets OG5_128200 All targets in OG5_128200
Schistosoma japonicum ko:K00635 diacylglycerol O-acyltransferase [EC2.3.1.20], putative Get druggable targets OG5_128200 All targets in OG5_128200
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128200 All targets in OG5_128200
Neospora caninum sterol O-acyltransferase, putative Get druggable targets OG5_128200 All targets in OG5_128200
Schistosoma japonicum Diacylglycerol O-acyltransferase 1, putative Get druggable targets OG5_128200 All targets in OG5_128200
Babesia bovis diacylglycerol acyltransferase, putative Get druggable targets OG5_128200 All targets in OG5_128200
Neospora caninum diacylglycerol acyltransferase, putative Get druggable targets OG5_128200 All targets in OG5_128200
Schistosoma mansoni diacylglycerol O-acyltransferase 1 Get druggable targets OG5_128200 All targets in OG5_128200
Brugia malayi diacylglycerol acyltransferase Get druggable targets OG5_128200 All targets in OG5_128200
Schistosoma japonicum Diacylglycerol O-acyltransferase 1, putative Get druggable targets OG5_128200 All targets in OG5_128200
Plasmodium vivax diacylglycerol O-acyltransferase, putative Get druggable targets OG5_128200 All targets in OG5_128200
Echinococcus granulosus diacylglycerol O acyltransferase 1 Get druggable targets OG5_128200 All targets in OG5_128200
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) ImpB/MucB/SamB family protein 0.002 0.0142 0.0112
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0018 0.0112 0.006
Schistosoma mansoni hypothetical protein 0.0052 0.062 0.062
Brugia malayi Regulator of G protein signaling domain containing protein 0.002 0.014 0.014
Brugia malayi serine/threonine-protein kinase plk-2 0.0099 0.1352 0.1352
Echinococcus multilocularis A kinase anchor protein 10, mitochondrial 0.002 0.014 0.0088
Trypanosoma cruzi homoserine kinase 0.0304 0.4487 0.4424
Schistosoma mansoni jumonji domain containing protein 0.008 0.1053 0.1053
Schistosoma mansoni ap endonuclease 0.0018 0.0112 0.0112
Onchocerca volvulus 0.0052 0.062 0.0384
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0027 0.0246 0.0194
Trichomonas vaginalis conserved hypothetical protein 0.002 0.014 0.0028
Echinococcus granulosus regulator of G protein signaling 7 0.002 0.014 0.0088
Trypanosoma cruzi polo-like protein kinase, putative 0.0099 0.1352 0.1254
Schistosoma mansoni hypothetical protein 0.0031 0.0301 0.0301
Plasmodium vivax diacylglycerol O-acyltransferase, putative 0.0307 0.4524 1
Entamoeba histolytica vacuolar protein sorting 26 0.0052 0.062 0.1161
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0142 0.0097
Brugia malayi exodeoxyribonuclease III family protein 0.0018 0.0112 0.0112
Loa Loa (eye worm) hypothetical protein 0.002 0.014 0.011
Mycobacterium ulcerans mannose-6-phosphate isomerase ManA 0.0107 0.1461 0.1364
Echinococcus granulosus muscleblind protein 0.0409 0.6083 0.6062
Echinococcus granulosus galactokinase 0.0304 0.4487 0.4458
Trichomonas vaginalis CAMK family protein kinase 0.0099 0.1352 0.1254
Trypanosoma cruzi phosphomannose isomerase, putative 0.0107 0.1461 0.1364
Trichomonas vaginalis conserved hypothetical protein 0.002 0.014 0.0028
Echinococcus granulosus Mevalonate galactokinase 0.0304 0.4487 0.4458
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0018 0.0112 0.0075
Brugia malayi regulator of G-protein signaling egl-10 0.002 0.014 0.014
Trichomonas vaginalis phosphomannomutase, putative 0.0047 0.0551 0.0443
Echinococcus multilocularis mitogen activated protein kinase kinase kinase 0.0094 0.1275 0.1229
Loa Loa (eye worm) hypothetical protein 0.002 0.0142 0.0112
Schistosoma mansoni membrane-bound acyltransferase/hhat 0.0052 0.062 0.062
Schistosoma mansoni galactokinase 0.0304 0.4487 0.4487
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0142 0.0097
Loa Loa (eye worm) MBOAT family protein 0.0052 0.062 0.0712
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0052 0.062 0.062
Trypanosoma brucei Putative Phosphatase/Protein of unknown function DUF89, putative 0.0119 0.1647 0.1609
Loa Loa (eye worm) hypothetical protein 0.0052 0.062 0.0712
Brugia malayi PHD-finger family protein 0.0031 0.0301 0.0301
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0042 0.0473 0.0527
Trypanosoma cruzi DNA polymerase kappa, putative 0.002 0.0142 0.003
Schistosoma mansoni axis inhibition protein axin 0.002 0.014 0.014
Trichomonas vaginalis CAMK family protein kinase 0.0099 0.1352 0.1254
Brugia malayi Protein kinase domain containing protein 0.0096 0.1305 0.1305
Schistosoma mansoni axis inhibition protein axin 0.002 0.014 0.014
Echinococcus multilocularis mitogen activated protein kinase kinase kinase 7 0.0094 0.1275 0.1229
Echinococcus multilocularis lysophospholipid acyltransferase 7 0.0052 0.062 0.0571
Plasmodium falciparum phd finger protein, putative 0.0031 0.0301 0.0427
Mycobacterium ulcerans 4-diphosphocytidyl-2-C-methyl-D-erythritol kinase 0.0304 0.4487 0.4424
Echinococcus multilocularis lysine specific demethylase 5A 0.0037 0.0399 0.0349
Entamoeba histolytica phosphomannomutase, putative 0.0047 0.0551 0.1002
Trichomonas vaginalis porcupine, putative 0.0052 0.062 0.0514
Onchocerca volvulus 0.0215 0.312 0.2947
Trypanosoma cruzi galactokinase, putative 0.0304 0.4487 0.4424
Echinococcus multilocularis dna polymerase eta 0.002 0.0142 0.009
Echinococcus multilocularis kinase protein 0.0094 0.1275 0.1229
Trypanosoma cruzi galactokinase, putative 0.0175 0.2513 0.2428
Trichomonas vaginalis CAMK family protein kinase 0.0049 0.0584 0.0477
Treponema pallidum hypothetical protein 0.0304 0.4487 1
Loa Loa (eye worm) hypothetical protein 0.0027 0.0246 0.0242
Entamoeba histolytica hypothetical protein, conserved 0.0052 0.062 0.1161
Leishmania major fucose kinase, putative 0.0129 0.1805 0.1712
Loa Loa (eye worm) hypothetical protein 0.0052 0.062 0.0712
Giardia lamblia Kinase, PLK 0.0099 0.1352 0.1254
Mycobacterium ulcerans mevalonate kinase, Erg12 0.0304 0.4487 0.4424
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.01 0.1368 0.1323
Entamoeba histolytica hypothetical protein 0.002 0.014 0.0064
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0046 0.053 0.053
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0014 0.0052 0.0052
Brugia malayi latrophilin 2 splice variant baaae 0.0031 0.0309 0.0309
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0027 0.0246 0.0246
Schistosoma mansoni serine/threonine protein kinase 0.002 0.0145 0.0145
Echinococcus granulosus phosphomannomutase 0.0047 0.0551 0.0501
Plasmodium falciparum phosphomannomutase, putative 0.0047 0.0551 0.0994
Trichomonas vaginalis conserved hypothetical protein 0.0129 0.1805 0.1712
Brugia malayi ImpB/MucB/SamB family protein 0.002 0.0142 0.0142
Trypanosoma brucei polo-like protein kinase 0.0099 0.1352 0.1312
Echinococcus granulosus mitogen activated protein kinase kinase kinase 0.0096 0.1305 0.1259
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0099 0.1352 0.1254
Trypanosoma cruzi phosphomevalonate kinase protein, putative 0.0129 0.1805 0.1712
Trichomonas vaginalis conserved hypothetical protein 0.002 0.014 0.0028
Trichomonas vaginalis mevalonate kinase, putative 0.0129 0.1805 0.1712
Schistosoma mansoni serine/threonine protein kinase 0.0099 0.1352 0.1352
Schistosoma mansoni serine/threonine protein kinase 0.002 0.0145 0.0145
Loa Loa (eye worm) hypothetical protein 0.0129 0.1805 0.2198
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0027 0.0246 0.0246
Trypanosoma cruzi galactokinase-like protein, putative 0.0175 0.2513 0.2428
Echinococcus granulosus o acyltransferase membrane bound domain 0.0052 0.062 0.0571
Trichomonas vaginalis conserved hypothetical protein 0.0052 0.062 0.0514
Trypanosoma cruzi glycerol uptake protein, putative 0.0052 0.062 0.0514
Toxoplasma gondii phosphomannomutase 0.0047 0.0551 0.0994
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0018 0.0112 0.006
Brugia malayi galactokinase family protein 0.0304 0.4487 0.4487
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0189 0.2721 0.3346
Echinococcus multilocularis muscleblind protein 1 0.0409 0.6083 0.6062
Entamoeba histolytica hypothetical protein 0.002 0.014 0.0064
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0042 0.0473 0.0422
Brugia malayi Calcitonin receptor-like protein seb-1 0.0046 0.053 0.053
Mycobacterium ulcerans homoserine kinase 0.0304 0.4487 0.4424
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.002 0.0142 0.0142
Toxoplasma gondii PHD-finger domain-containing protein 0.0031 0.0301 0.0427
Trichomonas vaginalis CAMK family protein kinase 0.0099 0.1352 0.1254
Echinococcus granulosus lysine specific demethylase 5A 0.0037 0.0399 0.0349
Trypanosoma cruzi DNA polymerase kappa, putative 0.002 0.0142 0.003
Echinococcus granulosus A kinase anchor protein 10 mitochondrial 0.002 0.014 0.0088
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0027 0.0246 0.0246
Leishmania major homoserine kinase, putative 0.0304 0.4487 0.4424
Mycobacterium ulcerans galactokinase 0.0304 0.4487 0.4424
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.002 0.0142 0.009
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.002 0.0142 0.003
Trichomonas vaginalis DNA polymerase eta, putative 0.002 0.0142 0.003
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0042 0.0473 0.0422
Trypanosoma cruzi DNA polymerase kappa, putative 0.002 0.0142 0.003
Mycobacterium ulcerans diphosphomevalonate decarboxylase 0.0665 1 1
Echinococcus granulosus diphosphomevalonate decarboxylase 0.0665 1 1
Echinococcus multilocularis Membrane bound O acyl transferase, MBOAT 0.0052 0.062 0.0571
Loa Loa (eye worm) AGC/GRK/BARK protein kinase 0.002 0.0145 0.0116
Echinococcus granulosus membrane bound acyltransferase:hhat 0.0052 0.062 0.0571
Trichomonas vaginalis galactokinase, putative 0.0304 0.4487 0.4424
Loa Loa (eye worm) mannose-6-phosphate isomerase 0.0107 0.1461 0.1767
Leishmania major phosphomevalonate kinase protein, putative 0.0304 0.4487 0.4424
Loa Loa (eye worm) TKL/MLK/TAK1 protein kinase 0.0096 0.1305 0.157
Schistosoma mansoni hypothetical protein 0.0014 0.0052 0.0052
Trypanosoma brucei glycerol uptake protein, putative 0.0052 0.062 0.0577
Echinococcus granulosus Membrane bound O acyl transferase MBOAT 0.0052 0.062 0.0571
Echinococcus granulosus axis inhibition protein axin 0.002 0.014 0.0088
Echinococcus multilocularis mitogen activated protein kinase kinase kinase 0.0094 0.1275 0.1229
Entamoeba histolytica hypothetical protein 0.002 0.014 0.0064
Echinococcus multilocularis protein cysteine N palmitoyltransferase 0.0052 0.062 0.0571
Brugia malayi regulator of G-protein signaling rgs-7 0.002 0.014 0.014
Echinococcus granulosus dna polymerase eta 0.002 0.0142 0.009
Loa Loa (eye worm) hypothetical protein 0.0052 0.062 0.0712
Trypanosoma cruzi Putative Phosphatase/Protein of unknown function DUF89, putative 0.0119 0.1647 0.1552
Giardia lamblia DINP protein human, muc B family 0.002 0.0142 0.003
Echinococcus granulosus N acetylgalactosamine kinase 0.0304 0.4487 0.4458
Echinococcus granulosus o acyltransferase membrane bound domain 0.0052 0.062 0.0571
Trichomonas vaginalis conserved hypothetical protein 0.0052 0.062 0.0514
Onchocerca volvulus Serine\/threonine kinase homolog 0.0099 0.1352 0.1134
Loa Loa (eye worm) galactokinase 0.0304 0.4487 0.5561
Trichomonas vaginalis galactokinase, putative 0.0304 0.4487 0.4424
Echinococcus multilocularis sterol O acyltransferase 1 0.0052 0.062 0.0571
Brugia malayi MBOAT family protein 0.0052 0.062 0.062
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0052 0.062 0.0571
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0142 0.0097
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0031 0.0301 0.0301
Echinococcus multilocularis axis inhibition protein axin 0.002 0.014 0.0088
Trichomonas vaginalis CAMK family protein kinase 0.0099 0.1352 0.1254
Echinococcus granulosus sterol O acyltransferase 1 0.0052 0.062 0.0571
Wolbachia endosymbiont of Brugia malayi 4-diphosphocytidyl-2-C-methyl-D-erythritol kinase 0.0304 0.4487 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0042 0.0473 0.0422
Trypanosoma cruzi Putative Phosphatase/Protein of unknown function DUF89, putative 0.0119 0.1647 0.1552
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0042 0.0473 0.0473
Trypanosoma cruzi mevalonate kinase, putative 0.0304 0.4487 0.4424
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0042 0.0473 0.0422
Echinococcus granulosus protein cysteine N palmitoyltransferase 0.0052 0.062 0.0571
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.002 0.0142 0.0068
Leishmania major DNA polymerase kappa, putative 0.002 0.0142 0.003
Leishmania major phosphomannomutase, putative 0.0047 0.0551 0.0443
Schistosoma mansoni hypothetical protein 0.0014 0.0052 0.0052
Brugia malayi Probable G protein-coupled receptor kinase F19C6.1, putative 0.002 0.0145 0.0145
Trypanosoma cruzi GUP1, putative 0.0052 0.062 0.0514
Mycobacterium tuberculosis Probable mannose-6-phosphate isomerase ManA (phosphomannose isomerase) (phosphomannoisomerase) (PMI) (phosphohexoisomerase) (pho 0.0058 0.0715 0.1378
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0027 0.0246 0.0194
Plasmodium vivax phosphomannomutase, putative 0.0047 0.0551 0.0994
Echinococcus granulosus regulator of G protein signaling 3 0.002 0.014 0.0088
Echinococcus granulosus regulator of G protein signaling 7 0.002 0.014 0.0088
Loa Loa (eye worm) hypothetical protein 0.0087 0.1161 0.139
Trypanosoma cruzi phosphomannose isomerase, putative 0.0107 0.1461 0.1364
Trichomonas vaginalis CAMK family protein kinase 0.0099 0.1352 0.1254
Echinococcus granulosus 5'partial|3'partial|mitogen activated protein kinase kinase kinase 0.0094 0.1275 0.1229
Brugia malayi jmjC domain containing protein 0.01 0.1368 0.1368
Loa Loa (eye worm) hypothetical protein 0.0052 0.062 0.0712
Giardia lamblia Diphosphomevalonate decarboxylase 0.0665 1 1
Echinococcus multilocularis PHD finger protein rhinoceros 0.0031 0.0301 0.025
Toxoplasma gondii PHD-finger domain-containing protein 0.0031 0.0301 0.0427
Trypanosoma brucei phosphomannose isomerase 0.0107 0.1461 0.1422
Schistosoma mansoni jumonji/arid domain-containing protein 0.0037 0.0399 0.0399
Schistosoma mansoni z-protein (S1r protein) 0.002 0.014 0.014
Schistosoma mansoni terminal deoxycytidyl transferase 0.002 0.0142 0.0142
Trichomonas vaginalis galactokinase, putative 0.0175 0.2513 0.2428
Brugia malayi ImpB/MucB/SamB family protein 0.002 0.0142 0.0142
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.002 0.0142 0.003
Schistosoma mansoni DNA polymerase eta 0.002 0.0142 0.0142
Echinococcus multilocularis peregrin 0.0031 0.0301 0.025
Brugia malayi mevalonate kinase family protein 0.0304 0.4487 0.4487
Trypanosoma cruzi glycerol uptake protein, putative 0.0052 0.062 0.0514
Brugia malayi phosphomannomutase 2 0.0047 0.0551 0.0551
Echinococcus multilocularis mitogen activated protein kinase kinase kinase 0.0094 0.1275 0.1229
Trypanosoma cruzi phosphomevalonate kinase protein, putative 0.0129 0.1805 0.1712
Echinococcus multilocularis Regulator of G protein signaling 20 0.002 0.014 0.0088
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0018 0.0112 0.0067
Loa Loa (eye worm) hypothetical protein 0.0031 0.0301 0.0311
Treponema pallidum galactokinase 0.0175 0.2513 0.5489
Echinococcus multilocularis diphosphomevalonate decarboxylase 0.0665 1 1
Echinococcus granulosus beta-adrenergic receptor kinase 0.002 0.0145 0.0093
Trypanosoma brucei mevalonate kinase, putative 0.0304 0.4487 0.4462
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0046 0.053 0.0599
Mycobacterium leprae Probable 4-diphosphocytidyl-2-C-methyl-D-erythritol kinase IspE (CMK) (4-(cytidine-5'-diphospho)-2-C-methyl-D-erythritol kinase) 0.0304 0.4487 1
Echinococcus granulosus histone lysine methyltransferase setb 0.0027 0.0246 0.0194
Schistosoma mansoni protein phosphatase 2C 0.0013 0.003 0.003
Loa Loa (eye worm) MBOAT family protein 0.0052 0.062 0.0712
Trypanosoma brucei DNA polymerase eta, putative 0.002 0.0142 0.0097
Brugia malayi MBOAT family protein 0.0052 0.062 0.062
Brugia malayi diacylglycerol acyltransferase 0.0307 0.4524 0.4524
Trypanosoma cruzi fucose kinase, putative 0.0175 0.2513 0.2428
Loa Loa (eye worm) PHD-finger family protein 0.0031 0.0301 0.0311
Echinococcus multilocularis regulator of G protein signaling 0.002 0.014 0.0088
Schistosoma mansoni kinase 0.0051 0.0604 0.0604
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0052 0.062 0.062
Trypanosoma cruzi DNA polymerase kappa, putative 0.002 0.0142 0.003
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.002 0.0142 0.009
Trypanosoma brucei DNA polymerase IV, putative 0.002 0.0142 0.0097
Onchocerca volvulus Putative phosphomannomutase 0.0047 0.0551 0.0312
Loa Loa (eye worm) jmjC domain-containing protein 0.0063 0.08 0.0938
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0052 0.062 0.0571
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0052 0.062 0.1161
Schistosoma mansoni mevalonate kinase 0.0304 0.4487 0.4487
Echinococcus multilocularis galactokinase 0.0304 0.4487 0.4458
Loa Loa (eye worm) hypothetical protein 0.002 0.014 0.011
Brugia malayi MBOAT family protein 0.0052 0.062 0.062
Trypanosoma brucei phosphomevalonate kinase protein, putative 0.0304 0.4487 0.4462
Schistosoma mansoni leukocyte receptor cluster (lrc) member 4 protein 0.0052 0.062 0.062
Echinococcus multilocularis regulator of G protein signaling 7 0.002 0.014 0.0088
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.002 0.014 0.014
Leishmania major glycerol uptake protein, putative 0.0052 0.062 0.0514
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0142 0.0097
Echinococcus multilocularis membrane bound acyltransferase:hhat 0.0052 0.062 0.0571
Trichomonas vaginalis conserved hypothetical protein 0.0052 0.062 0.0514
Trichomonas vaginalis diphosphomevalonate decarboxylase, putative 0.0665 1 1
Loa Loa (eye worm) hypothetical protein 0.0255 0.3735 0.4618
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0099 0.1352 0.1306
Giardia lamblia PHD finger protein 15 0.0031 0.0301 0.0191
Echinococcus granulosus geminin 0.016 0.2272 0.2231
Trypanosoma cruzi phosphomannomutase, putative 0.0047 0.0551 0.0443
Leishmania major mevalonate-diphosphate decarboxylase, putative 0.0665 1 1
Schistosoma mansoni sterol O-acyltransferase 1 0.0052 0.062 0.062
Loa Loa (eye worm) hypothetical protein 0.002 0.014 0.011
Plasmodium vivax hypothetical protein, conserved 0.0031 0.0301 0.0427
Brugia malayi Muscleblind-like protein 0.0409 0.6083 0.6083
Entamoeba histolytica galactokinase, putative 0.0304 0.4487 1
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.01 0.1368 0.1323
Leishmania major phosphomannose isomerase 0.0107 0.1461 0.1364
Echinococcus granulosus regulator of G protein signaling 3 0.002 0.014 0.0088
Treponema pallidum alginate O-acetylation protein (algI) 0.0052 0.062 0.1161
Trichomonas vaginalis CAMK family protein kinase 0.0099 0.1352 0.1254
Echinococcus multilocularis expressed protein 0.0393 0.584 0.5818
Onchocerca volvulus Alhambra homolog 0.0031 0.0301 0.0056
Trichomonas vaginalis galactokinase, putative 0.0304 0.4487 0.4424
Trypanosoma cruzi homoserine kinase 0.0304 0.4487 0.4424
Schistosoma mansoni regulator of G protein signaling 0.002 0.014 0.014
Loa Loa (eye worm) AGC/GRK/GRK protein kinase 0.002 0.0145 0.0116
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0142 0.0097
Schistosoma mansoni hypothetical protein 0.0014 0.0052 0.0052
Echinococcus multilocularis dna polymerase kappa 0.002 0.0142 0.009
Loa Loa (eye worm) RGS-3 protein 0.002 0.014 0.011
Brugia malayi Hhat protein 0.0052 0.062 0.062
Loa Loa (eye worm) membrane bound O-acyltransferase domain containing 1 0.0052 0.062 0.0712
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0027 0.0246 0.0303
Schistosoma mansoni regulator of G protein signaling 0.002 0.014 0.014
Mycobacterium leprae PROBABLE HOMOSERINE KINASE THRB 0.0129 0.1805 0.289
Leishmania major glycerol uptake protein, putative 0.0052 0.062 0.0514
Plasmodium vivax mannose-6-phosphate isomerase, putative 0.0107 0.1461 0.3058
Echinococcus granulosus mannose 6 phosphate isomerase 0.0107 0.1461 0.1416
Echinococcus multilocularis mitogen activated protein kinase kinase kinase 0.0096 0.1305 0.1259
Brugia malayi Regulator of G protein signaling domain containing protein 0.002 0.014 0.014
Brugia malayi Pre-SET motif family protein 0.0027 0.0246 0.0246
Schistosoma mansoni mannose-6-phosphate isomerase 0.0107 0.1461 0.1461
Trypanosoma brucei galactokinase-like protein, putative 0.0129 0.1805 0.1767
Brugia malayi mannose-6-phosphate isomerase, class I family protein 0.0107 0.1461 0.1461
Brugia malayi MBOAT family protein 0.0052 0.062 0.062
Plasmodium falciparum mannose-6-phosphate isomerase, putative 0.0107 0.1461 0.3058
Schistosoma mansoni diphosphomevalonate decarboxylase 0.0665 1 1
Brugia malayi hypothetical protein 0.002 0.014 0.014
Trichomonas vaginalis conserved hypothetical protein 0.002 0.014 0.0028
Loa Loa (eye worm) hhat protein 0.0052 0.062 0.0712
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0052 0.062 0.0571
Trichomonas vaginalis regulator of G protein signaling 5, rgs5, putative 0.002 0.014 0.0028
Schistosoma mansoni zinc finger protein 0.0052 0.062 0.062
Echinococcus multilocularis regulator of G protein signaling 3 0.002 0.014 0.0088
Echinococcus multilocularis diacylglycerol O acyltransferase 1 0.0307 0.4524 0.4495
Plasmodium vivax SET domain protein, putative 0.0027 0.0246 0.0303
Schistosoma mansoni jumonji/arid domain-containing protein 0.0037 0.0399 0.0399
Toxoplasma gondii acyl-CoA:diacylglycerol acyltransferase 1-related enzyme 0.0307 0.4524 1
Trichomonas vaginalis galactokinase, putative 0.0129 0.1805 0.1712
Brugia malayi PXA domain containing protein 0.002 0.014 0.014
Trypanosoma brucei homoserine kinase 0.0304 0.4487 0.4462
Brugia malayi PXA domain containing protein 0.002 0.014 0.014
Entamoeba histolytica phosphomannose isomerase, putative 0.0107 0.1461 0.3084
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0052 0.062 0.062
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0026 0.0231 0.0179
Schistosoma mansoni hypothetical protein 0.0014 0.0052 0.0052
Leishmania major hypothetical protein, conserved 0.0052 0.062 0.0514
Echinococcus multilocularis muscleblind protein 0.0409 0.6083 0.6062
Schistosoma mansoni serine/threonine protein kinase 0.002 0.0145 0.0145
Leishmania major glycerol uptake protein, putative 0.0052 0.062 0.0514
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0142 0.0097
Loa Loa (eye worm) PXA domain-containing protein 0.002 0.014 0.011
Echinococcus multilocularis Mevalonate galactokinase 0.0304 0.4487 0.4458
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0099 0.1352 0.1306
Echinococcus multilocularis phosphomannomutase 0.0047 0.0551 0.0501
Leishmania major DNA polymerase eta, putative 0.002 0.0142 0.003
Toxoplasma gondii hypothetical protein 0.0052 0.062 0.1151
Trypanosoma cruzi DNA polymerase eta, putative 0.002 0.0142 0.003
Loa Loa (eye worm) hypothetical protein 0.0409 0.6083 0.7563
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0042 0.0473 0.0473
Trichomonas vaginalis CAMK family protein kinase 0.0099 0.1352 0.1254
Echinococcus granulosus jumonji domain containing protein 0.0043 0.0484 0.0434
Trypanosoma cruzi mevalonate-diphosphate decarboxylase, putative 0.0665 1 1
Echinococcus multilocularis N acetylgalactosamine kinase 0.0304 0.4487 0.4458
Schistosoma mansoni ap endonuclease 0.0018 0.0112 0.0112
Loa Loa (eye worm) G protein signaling regulator EGL-10 0.002 0.014 0.011
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0099 0.1352 0.163
Mycobacterium ulcerans DNA polymerase IV 0.002 0.0142 0.003
Mycobacterium tuberculosis Probable homoserine kinase ThrB 0.0129 0.1805 0.387
Trichomonas vaginalis mannose-6-phosphate isomerase, putative 0.0107 0.1461 0.1364
Schistosoma mansoni regulator of G protein signaling 0.002 0.014 0.014
Trichomonas vaginalis transmembrane protein nessy, putative 0.0052 0.062 0.0514
Trypanosoma cruzi polo-like protein kinase, putative 0.0099 0.1352 0.1254
Loa Loa (eye worm) hypothetical protein 0.0536 0.8026 1
Entamoeba histolytica deoxycytidyl transferase, putative 0.002 0.0142 0.0068
Loa Loa (eye worm) mannose-6-phosphate isomerase 0.0107 0.1461 0.1767
Echinococcus granulosus lysophospholipid acyltransferase 7 0.0052 0.062 0.0571
Echinococcus multilocularis jumonji domain containing protein 0.0043 0.0484 0.0434
Schistosoma mansoni regulator of G protein signaling 3 rgs3 0.002 0.014 0.014
Trichomonas vaginalis conserved hypothetical protein 0.002 0.014 0.0028
Brugia malayi jmjC domain containing protein 0.0037 0.0399 0.0399
Toxoplasma gondii phosphomannose isomerase type I protein 0.0107 0.1461 0.3058
Echinococcus granulosus PHD finger protein rhinoceros 0.0031 0.0301 0.025
Trypanosoma brucei glycerol uptake protein, putative 0.0052 0.062 0.0577
Echinococcus multilocularis kinase protein 0.0094 0.1275 0.1229
Trypanosoma cruzi mevalonate-diphosphate decarboxylase, putative 0.0665 1 1
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0142 0.0097
Echinococcus multilocularis geminin 0.016 0.2272 0.2231
Chlamydia trachomatis 4-diphosphocytidyl-2-C-methyl-D-erythritol kinase 0.0129 0.1805 0.5
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0142 0.0097
Brugia malayi hypothetical protein 0.002 0.014 0.014
Leishmania major galactokinase-like protein 0.0304 0.4487 0.4424
Trichomonas vaginalis set domain proteins, putative 0.0215 0.312 0.3042
Loa Loa (eye worm) hypothetical protein 0.0053 0.0636 0.0732
Schistosoma mansoni hypothetical protein 0.016 0.2272 0.2272
Plasmodium falciparum diacylglycerol O-acyltransferase 0.0307 0.4524 1
Brugia malayi Pre-SET motif family protein 0.0189 0.2721 0.2721
Loa Loa (eye worm) diphosphomevalonate decarboxylase 0.0536 0.8026 1
Leishmania major mevalonate kinase, putative 0.0304 0.4487 0.4424
Mycobacterium ulcerans DNA polymerase IV 0.002 0.0142 0.003
Schistosoma mansoni phosphomannomutase 0.0047 0.0551 0.0551
Echinococcus granulosus expressed protein 0.0393 0.584 0.5818
Echinococcus granulosus peregrin 0.0031 0.0301 0.025
Loa Loa (eye worm) hypothetical protein 0.0046 0.053 0.0599
Trypanosoma cruzi glycerol uptake protein, putative 0.0052 0.062 0.0514
Loa Loa (eye worm) hypothetical protein 0.002 0.014 0.011
Trypanosoma brucei mevalonate-diphosphate decarboxylase 0.0665 1 1
Mycobacterium ulcerans phosphomevalonate kinase 0.0304 0.4487 0.4424
Echinococcus granulosus dna polymerase kappa 0.002 0.0142 0.009
Brugia malayi MBOAT family protein 0.0052 0.062 0.062
Echinococcus granulosus 3'partial|mitogen activated protein kinase kinase kinase 0.0094 0.1275 0.1229
Trypanosoma brucei DNA polymerase IV, putative 0.002 0.0142 0.0097
Loa Loa (eye worm) hypothetical protein 0.0304 0.4487 0.5561
Echinococcus granulosus Regulator of G protein signaling 20 0.002 0.014 0.0088
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0027 0.0246 0.0246
Schistosoma mansoni regulator of G protein signaling 0.002 0.014 0.014
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0142 0.0097
Echinococcus granulosus axis inhibition protein axin 0.002 0.014 0.0088
Loa Loa (eye worm) hypothetical protein 0.002 0.014 0.011
Trypanosoma brucei phosphomannomutase 0.0047 0.0551 0.0507
Echinococcus multilocularis regulator of G protein signaling 3 0.002 0.014 0.0088
Schistosoma mansoni regulator of G protein signaling 0.002 0.014 0.014
Loa Loa (eye worm) hypothetical protein 0.0409 0.6083 0.7563
Trypanosoma cruzi GUP1, putative 0.0052 0.062 0.0514
Leishmania major hypothetical protein, conserved 0.0119 0.1647 0.1552
Echinococcus granulosus o acyltransferase membrane bound domain 0.0052 0.062 0.0571
Trichomonas vaginalis CAMK family protein kinase 0.0049 0.0584 0.0477
Echinococcus multilocularis regulator of G protein signaling 7 0.002 0.014 0.0088
Schistosoma mansoni diacylglycerol O-acyltransferase 1 0.0307 0.4524 0.4524
Onchocerca volvulus 0.0665 1 1
Entamoeba histolytica Acid sphingomyelinase-like phosphodiesterase, putative 0.0087 0.1161 0.2397
Loa Loa (eye worm) MBOAT family protein 0.0052 0.062 0.0712
Leishmania major glycerol uptake protein, putative 0.0052 0.062 0.0514
Trypanosoma cruzi fucose kinase, putative 0.0175 0.2513 0.2428
Schistosoma mansoni hypothetical protein 0.0031 0.0309 0.0309
Leishmania major fucose kinase, putative 0.0129 0.1805 0.1712
Loa Loa (eye worm) diacylglycerol acyltransferase 0.0307 0.4524 0.5608
Brugia malayi Bromodomain containing protein 0.0031 0.0301 0.0301
Trypanosoma brucei DNA polymerase IV, putative 0.002 0.0142 0.0097
Mycobacterium tuberculosis Probable galactokinase GalK (galactose kinase) 0.0304 0.4487 1
Toxoplasma gondii GHMP kinase, putative 0.0304 0.4487 0.9916
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0142 0.0097
Brugia malayi A-kinase anchor protein 10, precursor 0.002 0.014 0.014
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.002 0.014 0.014
Echinococcus multilocularis beta adrenergic receptor kinase 0.002 0.0145 0.0093
Loa Loa (eye worm) jmjC domain-containing protein 0.0037 0.0399 0.0435
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0042 0.0473 0.0473
Echinococcus granulosus diacylglycerol O acyltransferase 1 0.0307 0.4524 0.4495
Brugia malayi Latrophilin receptor protein 2 0.0014 0.0052 0.0052
Mycobacterium tuberculosis Conserved hypothetical protein 0.002 0.0142 0.0068
Brugia malayi mannose-6-phosphate isomerase, class I family protein 0.0107 0.1461 0.1461
Toxoplasma gondii GHMP kinase, N-terminal domain-containing protein 0.0304 0.4487 0.9916
Toxoplasma gondii acyl-CoA:cholesterol acyltransferase alpha ACAT1-alpha 0.0307 0.4524 1
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0052 0.062 0.1161
Loa Loa (eye worm) hypothetical protein 0.0031 0.0309 0.0322
Trichomonas vaginalis conserved hypothetical protein 0.002 0.014 0.0028
Schistosoma mansoni hypothetical protein 0.016 0.2272 0.2272
Trypanosoma brucei unspecified product 0.002 0.0142 0.0097
Loa Loa (eye worm) phosphomannomutase 2 0.0047 0.0551 0.0625
Trypanosoma brucei mevalonate diphosphate decarboxylase 0.0665 1 1
Entamoeba histolytica mannose-6-phosphate isomerase, putative 0.0049 0.0578 0.1064
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0042 0.0473 0.0473
Loa Loa (eye worm) hhat protein 0.0052 0.062 0.0712
Entamoeba histolytica serine/threonine protein kinase, putative 0.0099 0.1352 0.2834
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0052 0.062 0.1161
Echinococcus multilocularis mannose 6 phosphate isomerase 0.0107 0.1461 0.1416
Trichomonas vaginalis galactokinase, putative 0.0304 0.4487 0.4424
Entamoeba histolytica hypothetical protein 0.0052 0.062 0.1161
Giardia lamblia Mevalonate kinase 0.0304 0.4487 0.4424
Loa Loa (eye worm) hypothetical protein 0.002 0.014 0.011
Mycobacterium tuberculosis Possible D-alpha-D-heptose-7-phosphate kinase HddA 0.0304 0.4487 1
Entamoeba histolytica Acid sphingomyelinase-like phosphodiesterase, putative 0.0087 0.1161 0.2397
Leishmania major glycerol uptake protein, putative 0.0052 0.062 0.0514
Trypanosoma cruzi galactokinase, putative 0.0304 0.4487 0.4424
Echinococcus multilocularis axis inhibition protein axin 0.002 0.014 0.0088

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 3600 nM Inhibition of human DGAT1 expressed in baculovirus infected Sf9 cells using [14C]oleoyl-CoA after 15 mins by TLC analysis ChEMBL. 20207151
IC50 (binding) = 5100 nM Inhibition of DGAT1 in mouse C2C12 cells assessed as suppression of [14C]triglyceride accumulation pretreated for 20 mins before [14C]oleic acid challenge measured after 20 mins by TLC analysis ChEMBL. 20207151

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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