Detailed information for compound 593793

Basic information

Technical information
  • TDR Targets ID: 593793
  • Name: 5,5-diethyl-1-methyl-2-piperidin-1-ylpyrimidi ne-4,6-dione
  • MW: 265.351 | Formula: C14H23N3O2
  • H donors: 0 H acceptors: 2 LogP: 1.77 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCC1(CC)C(=O)N=C(N(C1=O)C)N1CCCCC1
  • InChi: 1S/C14H23N3O2/c1-4-14(5-2)11(18)15-13(16(3)12(14)19)17-9-7-6-8-10-17/h4-10H2,1-3H3
  • InChiKey: HUBQGJZETQFWJL-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 5,5-diethyl-1-methyl-2-(1-piperidyl)pyrimidine-4,6-dione
  • 5,5-diethyl-1-methyl-2-piperidino-pyrimidine-4,6-quinone
  • 5,5-diethyl-1-methyl-2-piperidin-1-yl-pyrimidine-4,6-dione
  • ZINC02446967

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 histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0068 0.1649 0.1637
Echinococcus multilocularis snurportin 1 0.0328 0.906 0.9059
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0146 0.3876 0.3867
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0068 0.1649 0.1638
Schistosoma mansoni hypothetical protein 0.0362 1 1
Loa Loa (eye worm) hypothetical protein 0.0011 0.0015 0.0001
Brugia malayi nuclear hormone receptor 0.0011 0.0015 0.0024
Trypanosoma brucei importin beta-1 subunit, putative 0.0031 0.0584 0.6362
Echinococcus granulosus SAM and MBT domain containing protein 0.0051 0.1157 0.1144
Loa Loa (eye worm) hypothetical protein 0.008 0.1991 0.2186
Brugia malayi photoreceptor-specific nuclear receptor 0.0011 0.0015 0.0024
Schistosoma mansoni ran 0.0023 0.0352 0.0339
Loa Loa (eye worm) hypothetical protein 0.0064 0.1533 0.1679
Trypanosoma brucei importin beta-1 subunit, putative 0.0031 0.0584 0.6362
Brugia malayi RNA, U transporter 1 0.0088 0.2199 0.3634
Schistosoma mansoni zinc finger protein 0.0032 0.0618 0.0605
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0011 0.0015 0.0024
Loa Loa (eye worm) hypothetical protein 0.0011 0.0015 0.0001
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0014 0.0106 0.0092
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0203 0.5476 0.905
Loa Loa (eye worm) PHD-finger family protein 0.0043 0.0935 0.1019
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0014 0.0106 0.5
Onchocerca volvulus 0.0032 0.0615 0.0869
Schistosoma mansoni coup transcription factor 0.0011 0.0015 0.0001
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0011 0.0015 0.0024
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0023 0.0352 0.3282
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0201 0.5419 0.5412
Onchocerca volvulus 0.0051 0.1157 0.1653
Echinococcus granulosus histone acetyltransferase MYST2 0.0058 0.1357 0.1345
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0023 0.0352 0.3282
Schistosoma mansoni thyroid hormone receptor 0.0011 0.0015 0.0001
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0146 0.3876 0.3867
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0146 0.3876 0.3867
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0075 0.1846 0.1834
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0011 0.0015 0.0001
Loa Loa (eye worm) hypothetical protein 0.0011 0.0015 0.0001
Plasmodium vivax importin-beta 2, putative 0.0031 0.0584 0.6362
Loa Loa (eye worm) hypothetical protein 0.0091 0.2297 0.2524
Plasmodium vivax glutathione reductase, putative 0.004 0.0857 1
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0011 0.0015 0.0024
Brugia malayi nuclear receptor NHR-88 0.0011 0.0015 0.0024
Schistosoma mansoni sex comb on midleg homolog 0.0051 0.1157 0.1145
Schistosoma mansoni cpg binding protein 0.0038 0.0781 0.0768
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0146 0.3876 0.3867
Leishmania major trypanothione reductase 0.004 0.0857 1
Schistosoma mansoni cpg binding protein 0.0032 0.0615 0.0602
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0011 0.0015 0.0024
Brugia malayi Calcitonin receptor-like protein seb-1 0.0203 0.5476 0.905
Schistosoma mansoni importin beta-1 0.0031 0.0584 0.0571
Echinococcus granulosus GPCR family 2 0.0064 0.1533 0.152
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0102 0.2622 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0011 0.0015 0.0024
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0064 0.1533 0.152
Treponema pallidum NADH oxidase 0.0014 0.0106 0.5
Trichomonas vaginalis set domain proteins, putative 0.0253 0.6924 1
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0058 0.1357 0.1345
Brugia malayi mbt repeat family protein 0.0051 0.1157 0.1912
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0058 0.1357 0.2243
Echinococcus granulosus fetal alzheimer antigen falz 0.0049 0.1101 0.1088
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0011 0.0015 0.0001
Loa Loa (eye worm) latrophilin receptor protein 2 0.0064 0.1533 0.1679
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0092 0.2329 0.8837
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0049 0.1101 0.1088
Schistosoma mansoni hypothetical protein 0.0064 0.1533 0.1521
Schistosoma mansoni retinoic acid receptor RXR 0.0011 0.0015 0.0001
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0092 0.2329 0.8837
Mycobacterium tuberculosis Probable dehydrogenase 0.0092 0.2329 0.8837
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0328 0.906 1
Onchocerca volvulus 0.0253 0.6924 1
Schistosoma mansoni RAR-like nuclear receptor 0.0011 0.0015 0.0001
Brugia malayi mbt repeat family protein 0.0051 0.1157 0.1912
Schistosoma mansoni thyroid hormone receptor 0.0011 0.0015 0.0001
Schistosoma mansoni hypothetical protein 0.0309 0.8518 0.8516
Schistosoma mansoni sex comb on midleg homolog 0.0051 0.1157 0.1145
Brugia malayi latrophilin 2 splice variant baaae 0.0139 0.3651 0.6034
Echinococcus granulosus importin subunit beta 1 0.0031 0.0584 0.057
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0036 0.0722 0.0709
Toxoplasma gondii HEAT repeat-containing protein 0.0031 0.0584 0.3194
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0011 0.0015 0.0024
Brugia malayi Bromodomain containing protein 0.008 0.1987 0.3284
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0014 0.0106 0.0175
Brugia malayi Steroid receptor seven-up type 2 0.0011 0.0015 0.0024
Loa Loa (eye worm) CXXC zinc finger family protein 0.0032 0.0615 0.0665
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0023 0.0352 0.0582
Echinococcus multilocularis cpg binding protein 0.0038 0.0781 0.0767
Schistosoma mansoni zinc finger protein 0.0043 0.0924 0.0912
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0011 0.0015 0.0001
Trypanosoma brucei ISWI complex protein 0.0032 0.0618 0.682
Brugia malayi CXXC zinc finger family protein 0.0032 0.0615 0.1017
Schistosoma mansoni hypothetical protein 0.0043 0.0935 0.0923
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0011 0.0015 0.0001
Schistosoma mansoni myelin transcription factor 1 myt1 0.0058 0.1357 0.1345
Trypanosoma brucei trypanothione reductase 0.004 0.0857 1
Leishmania major GTP-binding protein, putative 0.0023 0.0352 0.3282
Schistosoma mansoni hypothetical protein 0.0064 0.1533 0.1521
Trichomonas vaginalis ran, putative 0.0023 0.0352 0.0362
Echinococcus multilocularis polycomb protein SCMH1 0.0051 0.1157 0.1144
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0092 0.2329 0.8837
Schistosoma mansoni methyl-cpg binding protein mbd 0.0036 0.0722 0.071
Trypanosoma cruzi ISWI complex protein 0.0032 0.0618 0.682
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0058 0.1357 0.1345
Loa Loa (eye worm) hypothetical protein 0.0051 0.1157 0.1263
Loa Loa (eye worm) hypothetical protein 0.0011 0.0015 0.0001
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0127 0.3312 0.3303
Echinococcus multilocularis importin subunit beta 1 0.0031 0.0584 0.057
Echinococcus granulosus polycomb protein SCMH1 0.0051 0.1157 0.1144
Echinococcus granulosus zinc finger protein 0.0043 0.0924 0.0911
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0069 0.1666 0.1655
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0011 0.0015 0.0024
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0023 0.0352 0.0338
Echinococcus granulosus histone lysine methyltransferase setb 0.0068 0.1649 0.1637
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0011 0.0015 0.0001
Leishmania major importin beta-1 subunit, putative 0.0025 0.0418 0.4156
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0146 0.3876 0.6405
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0146 0.3876 0.3867
Schistosoma mansoni nuclear hormone receptor 0.0011 0.0015 0.0001
Echinococcus multilocularis histone acetyltransferase MYST2 0.0058 0.1357 0.1345
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0011 0.0015 0.0024
Loa Loa (eye worm) hypothetical protein 0.0011 0.0015 0.0001
Trypanosoma cruzi importin beta-1 subunit, putative 0.0025 0.0418 0.4156
Echinococcus multilocularis thioredoxin glutathione reductase 0.0041 0.0872 0.0859
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0223 0.6051 0.6673
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0146 0.3876 0.3867
Plasmodium falciparum importin beta, putative 0.0031 0.0584 0.6362
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0203 0.5476 0.6038
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0014 0.0106 0.5
Brugia malayi steroid hormone receptor 0.0011 0.0015 0.0024
Leishmania major hypothetical protein, conserved 0.0032 0.0618 0.682
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0064 0.1533 0.2533
Schistosoma mansoni hypothetical protein 0.0328 0.906 0.9059
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0011 0.0015 0.0001
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0051 0.1157 0.1145
Loa Loa (eye worm) hypothetical protein 0.0011 0.0015 0.0001
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0068 0.1649 0.1638
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0075 0.1846 0.1834
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0011 0.0015 0.0001
Loa Loa (eye worm) mbt repeat family protein 0.0051 0.1157 0.1263
Loa Loa (eye worm) thioredoxin reductase 0.004 0.0857 0.0932
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0049 0.1101 0.1089
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0023 0.0352 0.3282
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0011 0.0015 0.0024
Entamoeba histolytica hypothetical protein 0.0025 0.0418 1
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0031 0.0581 0.0567
Schistosoma mansoni steroid hormone receptor ad4bp 0.0011 0.0015 0.0001
Loa Loa (eye worm) hypothetical protein 0.0139 0.3651 0.402
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0092 0.2329 0.8837
Schistosoma mansoni bromodomain containing protein 0.0134 0.3525 0.3516
Echinococcus granulosus methyl CpG binding domain protein 2 0.0036 0.0722 0.0709
Trichomonas vaginalis importin beta-1, putative 0.0025 0.0418 0.0458
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0011 0.0022 0.0007
Brugia malayi Pre-SET motif family protein 0.0223 0.6051 1
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0201 0.5419 0.5412
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0102 0.2622 1
Echinococcus granulosus snurportin 1 0.0328 0.906 0.9059
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0011 0.0015 0.0001
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0011 0.0015 0.0024
Loa Loa (eye worm) hypothetical protein 0.0011 0.0015 0.0001
Brugia malayi Thioredoxin reductase 0.004 0.0857 0.1416
Loa Loa (eye worm) hypothetical protein 0.0058 0.1357 0.1485
Loa Loa (eye worm) hypothetical protein 0.0011 0.0015 0.0001
Toxoplasma gondii histone lysine methyltransferase SET1 0.0067 0.1602 1
Schistosoma mansoni methyl-cpg binding protein mbd 0.0036 0.0722 0.071
Brugia malayi PHD-finger family protein 0.0054 0.1242 0.2052
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0064 0.1533 0.152
Loa Loa (eye worm) MBCTL1 0.0058 0.1357 0.1485
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0146 0.3876 0.3867
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0033 0.0634 0.0621
Brugia malayi Importin beta-1 subunit 0.0031 0.0584 0.0964
Echinococcus granulosus cpg binding protein 0.0038 0.0781 0.0767
Plasmodium vivax SET domain protein, putative 0.0033 0.0634 0.7037
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0014 0.0106 0.5
Mycobacterium tuberculosis Probable reductase 0.0092 0.2329 0.8837
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0023 0.0352 0.1648
Mycobacterium ulcerans flavoprotein disulfide reductase 0.0014 0.0106 0.5
Schistosoma mansoni ran 0.0023 0.0352 0.0339
Brugia malayi F/Y-rich N-terminus family protein 0.0015 0.0132 0.0218
Loa Loa (eye worm) hypothetical protein 0.0203 0.5476 0.6038
Loa Loa (eye worm) hypothetical protein 0.0068 0.1649 0.1808
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0051 0.1157 0.1653
Echinococcus granulosus thioredoxin glutathione reductase 0.0041 0.0872 0.0859
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0023 0.0352 0.0374
Schistosoma mansoni hypothetical protein 0.0064 0.1533 0.1521
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0025 0.0418 0.0458
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0023 0.0352 0.3282
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0023 0.0352 0.3282
Echinococcus multilocularis geminin 0.0362 1 1
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0033 0.0634 0.0621
Brugia malayi Latrophilin receptor protein 2 0.0064 0.1533 0.2533
Echinococcus multilocularis SAM and MBT domain containing protein 0.0051 0.1157 0.1144
Echinococcus multilocularis GPCR, family 2 0.0064 0.1533 0.152
Loa Loa (eye worm) steroid hormone receptor 0.0011 0.0015 0.0001
Mycobacterium ulcerans dihydrolipoamide dehydrogenase, LpdB 0.0014 0.0106 0.5
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0011 0.0015 0.0001
Echinococcus multilocularis zinc finger protein 0.0043 0.0924 0.0911
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0146 0.3876 0.4269
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0014 0.0106 0.0091
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.004 0.0857 0.2985
Echinococcus granulosus GTP binding nuclear protein Ran 0.0023 0.0352 0.0338
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0127 0.3312 0.3303
Trypanosoma cruzi trypanothione reductase, putative 0.004 0.0857 1
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0011 0.0015 0.0001
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0011 0.0015 0.0024
Loa Loa (eye worm) hypothetical protein 0.0031 0.0584 0.063
Plasmodium falciparum thioredoxin reductase 0.004 0.0857 1
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0023 0.0352 1
Onchocerca volvulus 0.0033 0.0634 0.0897
Schistosoma mansoni hypothetical protein 0.0032 0.0618 0.0605
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0033 0.0634 0.3534
Schistosoma mansoni hypothetical protein 0.0064 0.1533 0.1521
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0011 0.0015 0.0024
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0064 0.1533 0.152
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0064 0.1533 0.152
Brugia malayi glutathione reductase 0.004 0.0857 0.1416
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0011 0.0015 0.0001
Schistosoma mansoni cpg binding protein 0.0038 0.0781 0.0768
Mycobacterium tuberculosis Probable oxidoreductase 0.0102 0.2622 1
Mycobacterium ulcerans dihydrolipoamide dehydrogenase 0.0014 0.0106 0.5
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0025 0.0418 0.0458
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0033 0.0634 0.0621
Schistosoma mansoni hypothetical protein 0.0139 0.3651 0.3642
Loa Loa (eye worm) hypothetical protein 0.0148 0.3916 0.4314
Brugia malayi Nuclear hormone receptor-like 1 0.0011 0.0015 0.0024
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0011 0.0015 0.0001
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0011 0.0022 0.0007
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0011 0.0015 0.0001
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0014 0.0106 0.0091
Plasmodium falciparum glutathione reductase 0.004 0.0857 1
Loa Loa (eye worm) hypothetical protein 0.0085 0.2132 0.2341
Plasmodium vivax thioredoxin reductase, putative 0.004 0.0857 1
Brugia malayi Pre-SET motif family protein 0.0033 0.0634 0.1048
Trypanosoma cruzi ISWI complex protein 0.0032 0.0618 0.682
Loa Loa (eye worm) glutathione reductase 0.004 0.0857 0.0932
Brugia malayi ecdysteroid receptor 0.0011 0.0015 0.0024
Schistosoma mansoni hypothetical protein 0.0362 1 1
Loa Loa (eye worm) bromodomain containing protein 0.0037 0.0759 0.0824
Toxoplasma gondii thioredoxin reductase 0.004 0.0857 0.5021
Loa Loa (eye worm) histone methyltransferase 0.0011 0.0022 0.0009
Brugia malayi Bromodomain containing protein 0.0159 0.4223 0.6979
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0011 0.0015 0.0024
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0102 0.2622 1

Activities

Activity type Activity value Assay description Source Reference
Inhibition (functional) = 0 % GSK_TCMDC: Percent inhibition of human HepG2 cell line. Test compounds present at 10uM. ChEMBL. 20485427
Inhibition (functional) = 1 % GSK_TCMDC: Inhibition of Plasmodium falciparum 3D7 LDH activity, using an LDH reporter assay. Test compounds present at 2uM ChEMBL. 20485427
Inhibition (functional) = 5.99 % ST_JUDE_LEISH: Cytotoxicity at 2uM final concentration against transgenic Leishmania Mexicana promastigotes LmGT2 that are glucose transport deficient and complemented with the L. Mexicana glucose transporter 2. Activity is measured by by DNA content using SYBR green in vitro ChEMBL. No reference
Inhibition (functional) = 14.17 % ST_JUDE_LEISH: Cytotoxicity at 2uM final concentration against transgenic Leishmania Mexicana promastigotes LmPfHT that are glucose transport deficient and complemented with the Plasmodium falciparum hexose transporter. Activity is measured by by DNA content using SYBR green in vitro ChEMBL. No reference
Inhibition (functional) = 18.96 % ST_JUDE_LEISH: Cytotoxicity at 2uM final concentration against transgenic Leishmania Mexicana promastigotes LmGLUT1 that are glucose transport deficient and complemented with the human glucose transporter GLUT1. Activity is measured by DNA content using SYBR green in vitro ChEMBL. No reference
Inhibition (functional) = 66 % GSK_TCMDC: Inhibition of Plasmodium falciparum Dd2 in whole red blood cells, using parasite LDH activity as an index of growth. Test compounds present at 2uM ChEMBL. 20485427
Inhibition (functional) = 89 % GSK_TCMDC: Inhibition of Plasmodium falciparum 3D7 in whole red blood cells, using parasite LDH activity as an index of growth. Test compounds present at 2uM ChEMBL. 20485427
Inhibition frequency index (IFI) (functional) = 0.85 Inhibition Frequency Index (IFI) GSK. 20485427
Percent growth inhibition (functional) = -4 % Percent inhibition of HepG2 growth (at 10 uM) GSK. 20485427
Percent growth inhibition (functional) = 1 % Percent inhibition of P. falciparum lactate dehydrogenase activity (at 2 uM) GSK. 20485427
Percent growth inhibition (functional) = 66 % Percent inhibition of P. falciparum Dd2 growth (at 2 uM) GSK. 20485427
Percent growth inhibition (functional) = 89 % Percent inhibition of P. falciparum 3D7 growth (at 2 uM) GSK. 20485427
XC50 (functional) = 6.52 XC50 determination of P. falciparum 3D7 growth GSK. 20485427
XC50 (functional) = 0.30326 uM GSK_TCMDC: Inhibition of Plasmodium falciparum 3D7 in whole erythrocytes, using parasite LDH activity as an index of growth. ChEMBL. 20485427

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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