Detailed information for compound 283391

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 364.269 | Formula: C18H19Cl2N3O--
  • H donors: 1 H acceptors: 2 LogP: 4.36 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: CN(CCNC(=O)c1cccc2c1ncc1c2cccc1)C.[Cl-].[Cl-]
  • InChi: 1S/C18H19N3O.2ClH/c1-21(2)11-10-19-18(22)16-9-5-8-15-14-7-4-3-6-13(14)12-20-17(15)16;;/h3-9,12H,10-11H2,1-2H3,(H,19,22);2*1H/p-2
  • InChiKey: VZHVTLJOYGKBEM-UHFFFAOYSA-L  

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
Schistosoma mansoni transient receptor potential channel 0.0096 0.0048 0.004
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0178 0.0151 0.0349
Echinococcus multilocularis phosphatidylinositol 4 kinase alpha 0.0139 0.0101 0.0094
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0356 0.0372 0.1687
Schistosoma mansoni nAChR subunit 0.0178 0.0151 0.0143
Brugia malayi acetylcholine receptor alpha subunit precursor, putative 0.0178 0.0151 0.0349
Entamoeba histolytica phosphatidylinositol 3-kinase 1, putative 0.1032 0.1214 0.9676
Echinococcus granulosus glycine receptor subunit alpha 1 0.0178 0.0151 0.0143
Loa Loa (eye worm) hypothetical protein 0.0091 0.0043 0.0039
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0178 0.0151 0.0143
Entamoeba histolytica phosphatidylinositol 4-kinase, putative 0.0139 0.0101 0.0485
Schistosoma mansoni neurotransmitter gated ion channel 0.0091 0.0043 0.0035
Echinococcus granulosus transient receptor potential ion channel A 0.0092 0.0044 0.0036
Loa Loa (eye worm) hypothetical protein 0.0178 0.0151 0.0147
Schistosoma mansoni nAChR subunit 0.0178 0.0151 0.0143
Schistosoma mansoni nicotinic acetylcholine receptor alpha 0.0091 0.0043 0.0035
Loa Loa (eye worm) hypothetical protein 0.0087 0.0037 0.0033
Brugia malayi acetylcholine receptor, alpha-type subunit unc-38 precursor 0.0178 0.0151 0.0349
Brugia malayi nicotinic acetylcholine receptor alpha subunit, putative 0.0178 0.0151 0.0349
Plasmodium vivax tryptophan-rich antigen (Pv-fam-a) 0.0526 0.0584 1
Echinococcus multilocularis phosphatidylinositol 4 phosphate 3 kinase C2 0.0689 0.0787 0.078
Brugia malayi hypothetical protein 0.0087 0.0037 0.0061
Loa Loa (eye worm) hypothetical protein 0.0087 0.0037 0.0033
Loa Loa (eye worm) GABA receptor subunit 0.0091 0.0043 0.0039
Schistosoma mansoni transient receptor potential channel 4 0.0096 0.0048 0.004
Echinococcus granulosus nicotinic acetylcholine receptor beta 1 subunit 0.0178 0.0151 0.0143
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.1064 0.1253 1
Brugia malayi acetylcholine receptor protein, alpha-like chain, putative 0.0178 0.0151 0.0349
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0356 0.0372 0.091
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0091 0.0043 0.0035
Brugia malayi hypothetical protein 0.0236 0.0222 0.0531
Loa Loa (eye worm) ligand-Gated ion Channel family member 0.0178 0.0151 0.0147
Schistosoma mansoni nAChR subunit (ShAR1-alpha-like) 0.0178 0.0151 0.0143
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0178 0.0151 0.0143
Schistosoma mansoni hypothetical protein 0.0204 0.0183 0.0176
Loa Loa (eye worm) hypothetical protein 0.0091 0.0043 0.0039
Echinococcus granulosus sodium:potassium:calcium exchanger 6 0.0204 0.0183 0.0176
Echinococcus multilocularis nAChR subunit 0.0091 0.0043 0.0035
Echinococcus granulosus transient receptor potential gamma protein 0.0096 0.0048 0.004
Loa Loa (eye worm) nicotinic acetylcholine receptor alpha subunit 0.0178 0.0151 0.0147
Entamoeba histolytica hypothetical protein 0.0847 0.0983 0.7765
Plasmodium falciparum cation/H+ antiporter 0.0204 0.0183 1
Schistosoma mansoni nAChR subunit 0.0087 0.0037 0.0029
Loa Loa (eye worm) hypothetical protein 0.0652 0.0741 0.0738
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0178 0.0151 0.0349
Leishmania major phosphatidylinositol 3-kinase, putative 0.0139 0.0101 1
Trichomonas vaginalis alpha-L-fucosidase, putative 0.1427 0.1705 1
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0087 0.0037 0.0061
Onchocerca volvulus Putative nachr subunit 0.0178 0.0151 0.7789
Loa Loa (eye worm) hypothetical protein 0.0178 0.0151 0.0147
Brugia malayi K+-dependent Na+/Ca+ exchanger related-protein 0.0204 0.0183 0.0431
Loa Loa (eye worm) hypothetical protein 0.0178 0.0151 0.0147
Loa Loa (eye worm) hypothetical protein 0.0178 0.0151 0.0147
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0178 0.0151 0.0349
Loa Loa (eye worm) phosphatidylinositol 4-kinase type 3 alpha isoform 1 0.0139 0.0101 0.0098
Schistosoma mansoni nAChR subunit (ShAR1-beta-like) 0.0178 0.0151 0.0143
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.1064 0.1253 0.3145
Echinococcus multilocularis survival motor neuron protein 1 0.0236 0.0222 0.0215
Schistosoma mansoni nAChR subunit 0.0087 0.0037 0.0029
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0731 0.0839 0.4597
Mycobacterium tuberculosis Probable ionic transporter integral membrane protein ChaA 0.0204 0.0183 0.5
Echinococcus multilocularis nicotinic acetylcholine receptor subunit alpha 8 0.0178 0.0151 0.0143
Loa Loa (eye worm) nicotinic acetylcholine receptor non-alpha subunit 0.0178 0.0151 0.0147
Treponema pallidum hypothetical protein 0.0204 0.0183 0.5
Echinococcus granulosus phosphatidylinositol 4 kinase alpha 0.0139 0.0101 0.0094
Loa Loa (eye worm) hypothetical protein 0.0087 0.0037 0.0033
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.1064 0.1253 1
Loa Loa (eye worm) hypothetical protein 0.0178 0.0151 0.0147
Echinococcus granulosus neuronal acetylcholine receptor subunit alpha 4 0.0178 0.0151 0.0143
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.1064 0.1253 0.7184
Loa Loa (eye worm) hypothetical protein 0.0178 0.0151 0.0147
Trichomonas vaginalis conserved hypothetical protein 0.0204 0.0183 0.0509
Loa Loa (eye worm) hypothetical protein 0.0204 0.0183 0.018
Echinococcus granulosus phosphatidylinositol 4 phosphate 3 kinase C2 0.0689 0.0787 0.078
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0689 0.0787 0.1962
Loa Loa (eye worm) hypothetical protein 0.0178 0.0151 0.0147
Brugia malayi Cation transporter family protein 0.0178 0.0151 0.0349
Trypanosoma cruzi phosphatidylinositol 3-kinase, putative 0.0324 0.0333 0.2654
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0091 0.0043 0.0076
Schistosoma mansoni nAChR subunit 0.0178 0.0151 0.0143
Echinococcus multilocularis phosphatidylinositol 4,5 bisphosphate 3 kinase 0.1064 0.1253 0.1247
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0087 0.0037 0.0061
Loa Loa (eye worm) phosphatidylinositol 3 0.0847 0.0983 0.098
Loa Loa (eye worm) hypothetical protein 0.0178 0.0151 0.0147
Loa Loa (eye worm) hypothetical protein 0.0178 0.0151 0.0147
Brugia malayi hypothetical protein 0.0087 0.0037 0.0061
Loa Loa (eye worm) hypothetical protein 0.0087 0.0037 0.0033
Loa Loa (eye worm) hypothetical protein 0.0087 0.0037 0.0033
Loa Loa (eye worm) hypothetical protein 0.0178 0.0151 0.0147
Schistosoma mansoni nAChR subunit 0.0178 0.0151 0.0143
Entamoeba histolytica sodium/calcium exchanger protein, putative 0.0204 0.0183 0.1159
Loa Loa (eye worm) excitatory GABA receptor EXP-1A 0.0178 0.0151 0.0147
Schistosoma mansoni neurotransmitter gated ion channel 0.0087 0.0037 0.0029
Echinococcus multilocularis nicotinic acetylcholine receptor alpha subunit 0.0178 0.0151 0.0143
Loa Loa (eye worm) hypothetical protein 0.0087 0.0037 0.0033
Loa Loa (eye worm) ACC-1 protein 0.0178 0.0151 0.0147
Loa Loa (eye worm) hypothetical protein 0.0178 0.0151 0.0147
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0178 0.0151 0.0143
Brugia malayi Cation transporter family protein 0.0178 0.0151 0.0349
Trichomonas vaginalis alpha-L-fucosidase, putative 0.1427 0.1705 1
Echinococcus granulosus Cys loop ligand gated ion channel subunit 0.0087 0.0037 0.0029
Loa Loa (eye worm) hypothetical protein 0.0068 0.0013 0.0009
Loa Loa (eye worm) hypothetical protein 0.0087 0.0037 0.0033
Echinococcus granulosus glycine receptor subunit beta 0.0178 0.0151 0.0143
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0099 0.0052 0.0048
Echinococcus granulosus nicotinic acetylcholine receptor a11 subunit 0.0178 0.0151 0.0143
Echinococcus granulosus survival motor neuron protein 1 0.0236 0.0222 0.0215
Loa Loa (eye worm) hypothetical protein 0.0087 0.0037 0.0033
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0178 0.0151 0.0349
Echinococcus granulosus nicotinic acetylcholine receptor alpha subunit 0.0178 0.0151 0.0143
Trichomonas vaginalis conserved hypothetical protein 0.0204 0.0183 0.0509
Echinococcus multilocularis sodium calcium exchanger 0.8087 1 1
Trypanosoma brucei phosphatidylinositol 4-kinase alpha, putative 0.0139 0.0101 0.2589
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.1064 0.1253 0.1247
Echinococcus multilocularis transient receptor potential gamma protein 0.0096 0.0048 0.004
Echinococcus multilocularis nicotinic acetylcholine receptor a11 subunit 0.0178 0.0151 0.0143
Loa Loa (eye worm) hypothetical protein 0.0565 0.0633 0.063
Loa Loa (eye worm) hypothetical protein 0.0091 0.0043 0.0039
Brugia malayi Acetylcholine receptor protein, alpha-like chain 1 precursor 0.0087 0.0037 0.0061
Echinococcus multilocularis neuronal acetylcholine receptor subunit alpha 4 0.0178 0.0151 0.0143
Echinococcus multilocularis glycine receptor subunit beta 0.0178 0.0151 0.0143
Echinococcus granulosus acetylcholine receptor subunit beta 1 0.0178 0.0151 0.0143
Brugia malayi nicotinic acetylcholine receptor beta-1 chain precursor 0.0178 0.0151 0.0349
Echinococcus multilocularis sodium:potassium:calcium exchanger 6 0.0204 0.0183 0.0176
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0178 0.0151 0.0349
Loa Loa (eye worm) hypothetical protein 0.0204 0.0183 0.018
Loa Loa (eye worm) hypothetical protein 0.0689 0.0787 0.0784
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0847 0.0983 0.7765
Echinococcus multilocularis transient receptor potential ion channel A 0.0092 0.0044 0.0036
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0178 0.0151 0.0143
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0356 0.0372 0.2719
Loa Loa (eye worm) hypothetical protein 0.0087 0.0037 0.0033
Onchocerca volvulus 0.0178 0.0151 0.7789
Loa Loa (eye worm) glutamate-gated chloride channel alpha3A subunit 0.0087 0.0037 0.0033
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0139 0.0101 0.0094
Loa Loa (eye worm) solute carrier family 8 0.8087 1 1
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0178 0.0151 0.0143
Trypanosoma cruzi phosphatidylinositol 3-kinase vps34-like 0.0356 0.0372 0.2967
Mycobacterium leprae Probable ionic transporter integral membrane protein ChaA 0.0204 0.0183 0.5
Loa Loa (eye worm) hypothetical protein 0.0091 0.0043 0.0039
Loa Loa (eye worm) neuronal acetylcholine receptor protein 0.0087 0.0037 0.0033
Echinococcus multilocularis gamma aminobutyric acid receptor subunit 0.0087 0.0037 0.0029
Onchocerca volvulus 0.0178 0.0151 0.7789
Loa Loa (eye worm) hypothetical protein 0.3235 0.3957 0.3955
Echinococcus granulosus sodium:potassium:calcium exchanger 0.0204 0.0183 0.0176
Leishmania major phosphatidylinositol 4-kinase alpha, putative 0.0139 0.0101 1
Onchocerca volvulus 0.0178 0.0151 0.7789
Echinococcus multilocularis nicotinic acetylcholine receptor beta 1 subunit 0.0178 0.0151 0.0143
Onchocerca volvulus 0.0091 0.0043 0.0405
Loa Loa (eye worm) hypothetical protein 0.0099 0.0052 0.0048
Loa Loa (eye worm) phosphatidylinositol 3 0.0324 0.0333 0.0329
Loa Loa (eye worm) hypothetical protein 0.0375 0.0395 0.0392
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0178 0.0151 0.0349
Trypanosoma cruzi cruzipain precursor, putative 0.0063 0.0007 0.0054
Brugia malayi gamma-aminobutyric-acid receptor beta subunit precursor 0.0652 0.0741 0.1845
Toxoplasma gondii manganese resistance 1 protein, putative 0.0204 0.0183 1
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.1064 0.1253 0.7184
Plasmodium vivax cation/H+ antiporter, putative 0.0204 0.0183 0.1693
Onchocerca volvulus 0.0178 0.0151 0.7789
Loa Loa (eye worm) hypothetical protein 0.0087 0.0037 0.0033
Echinococcus granulosus gamma aminobutyric acid receptor subunit 0.0087 0.0037 0.0029
Loa Loa (eye worm) hypothetical protein 0.0087 0.0037 0.0033
Echinococcus multilocularis sodium:potassium:calcium exchanger 0.0204 0.0183 0.0176
Loa Loa (eye worm) hypothetical protein 0.0178 0.0151 0.0147
Brugia malayi Calcitonin receptor-like protein seb-1 0.0099 0.0052 0.0099
Loa Loa (eye worm) hypothetical protein 0.0091 0.0043 0.0039
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit gamma, putative 0.1064 0.1253 0.7184
Loa Loa (eye worm) hypothetical protein 0.0091 0.0043 0.0039
Schistosoma mansoni nAChR subunit 0.0178 0.0151 0.0143
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0356 0.0372 0.2719
Loa Loa (eye worm) acetylcholine receptor protein 0.0087 0.0037 0.0033
Brugia malayi hypothetical protein 0.0087 0.0037 0.0061
Brugia malayi hypothetical protein 0.0087 0.0037 0.0061
Schistosoma mansoni na/ca exchanger 0.0204 0.0183 0.0176
Echinococcus multilocularis Cys loop ligand gated ion channel subunit 0.0178 0.0151 0.0143
Echinococcus granulosus Cys loop ligand gated ion channel subunit 0.0178 0.0151 0.0143
Brugia malayi Neuronal acetylcholine receptor protein, alpha-2 chain precursor 0.0087 0.0037 0.0061
Echinococcus granulosus glycine receptor subunit alpha 1 0.0178 0.0151 0.0143
Echinococcus granulosus nAChR subunit 0.0178 0.0151 0.0143
Loa Loa (eye worm) hypothetical protein 0.0178 0.0151 0.0147
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0178 0.0151 0.0349
Brugia malayi Na/Ca eXchangers family member (ncx-4) 0.0204 0.0183 0.0431
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.0139 0.0101 0.0808
Onchocerca volvulus 0.0178 0.0151 0.7789
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0178 0.0151 0.0349
Schistosoma mansoni neurotransmitter gated ion channel 0.0087 0.0037 0.0029
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0178 0.0151 0.0349
Echinococcus multilocularis Zinc finger, PHD finger 0.0139 0.0101 0.0094
Loa Loa (eye worm) Na/Ca eXchangers family member 0.0204 0.0183 0.018
Giardia lamblia Phosphoinositide-3-kinase, catalytic, alpha polypeptide 0.0513 0.0568 1
Trypanosoma cruzi cysteine peptidase, putative 0.0063 0.0007 0.0054
Brugia malayi phosphatidylinositol 4-kinase, catalytic, alpha polypeptide 0.0139 0.0101 0.0224
Echinococcus multilocularis Cys loop ligand gated ion channel subunit 0.0087 0.0037 0.0029
Loa Loa (eye worm) ACC-1 protein 0.0178 0.0151 0.0147
Echinococcus granulosus glycine receptor subunit alpha 1 0.0178 0.0151 0.0143
Loa Loa (eye worm) hypothetical protein 0.0178 0.0151 0.0147
Brugia malayi glutamate-gated chloride channel alpha3A subunit, putative 0.0087 0.0037 0.0061
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0178 0.0151 0.0143
Schistosoma mansoni nAChR subunit 0.0178 0.0151 0.0143
Brugia malayi hypothetical protein 0.0087 0.0037 0.0061
Onchocerca volvulus 0.0091 0.0043 0.0405
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.1064 0.1253 1
Echinococcus multilocularis glycine receptor subunit beta 0.0178 0.0151 0.0143
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.0139 0.0101 0.0808
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0087 0.0037 0.0061
Echinococcus granulosus phosphatidylinositol 45 bisphosphate 3 kinase 0.1064 0.1253 0.1247
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0099 0.0052 0.0099
Schistosoma mansoni hypothetical protein 0.0068 0.0013 0.0005
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0472 0.0516 0.3911
Brugia malayi glutamate-gated chloride channel alpha3A subunit, putative 0.0091 0.0043 0.0076
Loa Loa (eye worm) hypothetical protein 0.0087 0.0037 0.0033
Brugia malayi excitatory GABA receptor EXP-1A 0.0178 0.0151 0.0349
Loa Loa (eye worm) hypothetical protein 0.0775 0.0894 0.0891
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0091 0.0043 0.0076
Schistosoma mansoni phosphatidylinositol 4-kinase 0.0139 0.0101 0.0094
Entamoeba histolytica phosphatidylinositol-4,5-bisphosphate 3-kinase, putative 0.0139 0.0101 0.0485
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0356 0.0372 0.1687
Echinococcus multilocularis acetylcholine receptor subunit beta 1 0.0178 0.0151 0.0143
Loa Loa (eye worm) hypothetical protein 0.0178 0.0151 0.0147
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0356 0.0372 0.0365
Brugia malayi Cation transporter family protein 0.0178 0.0151 0.0349
Trypanosoma cruzi cysteine peptidase, putative 0.0063 0.0007 0.0054
Schistosoma mansoni acetylcholine receptor subunit beta 0.0087 0.0037 0.0029
Echinococcus granulosus nAChR subunit 0.0091 0.0043 0.0035
Echinococcus granulosus phosphatidylinositol 3 kinase catalytic subunit 0.0139 0.0101 0.0094
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0356 0.0372 1
Trichomonas vaginalis conserved hypothetical protein 0.0204 0.0183 0.0509
Loa Loa (eye worm) hypothetical protein 0.0091 0.0043 0.0039
Loa Loa (eye worm) hypothetical protein 0.0087 0.0037 0.0033
Brugia malayi Hypothetical glycine receptor like protein T20B12.9 in chromosome III 0.0091 0.0043 0.0076
Onchocerca volvulus Sodium\/potassium\/calcium exchanger 0.0204 0.0183 1
Loa Loa (eye worm) hypothetical protein 0.0087 0.0037 0.0033
Loa Loa (eye worm) acetylcholine receptor alpha subunit 0.0178 0.0151 0.0147
Schistosoma mansoni potassium-dependent sodium-calcium exchanger 3 4 0.0204 0.0183 0.0176
Echinococcus multilocularis nicotinic acetylcholine receptor subunit type 0.0087 0.0037 0.0029
Echinococcus multilocularis nAChR subunit 0.0178 0.0151 0.0143
Brugia malayi Hypothetical glycine receptor like protein T20B12.9 in chromosome III 0.0178 0.0151 0.0349
Schistosoma mansoni nAChR subunit 0.0178 0.0151 0.0143
Echinococcus granulosus nicotinic acetylcholine receptor subunit type 0.0178 0.0151 0.0143
Onchocerca volvulus 0.0178 0.0151 0.7789
Loa Loa (eye worm) LGC-31 protein 0.0178 0.0151 0.0147
Echinococcus granulosus nicotinic acetylcholine receptor subunit alpha 8 0.0178 0.0151 0.0143
Loa Loa (eye worm) hypothetical protein 0.0178 0.0151 0.0147
Loa Loa (eye worm) hypothetical protein 0.0087 0.0037 0.0033
Trypanosoma cruzi cysteine peptidase, putative 0.0063 0.0007 0.0054
Loa Loa (eye worm) hypothetical protein 0.0204 0.0183 0.018
Loa Loa (eye worm) hypothetical protein 0.0096 0.0048 0.0044
Loa Loa (eye worm) hypothetical protein 0.0236 0.0222 0.0219
Loa Loa (eye worm) hypothetical protein 0.0091 0.0043 0.0039
Brugia malayi Sodium/calcium exchanger protein 0.3235 0.3957 1
Loa Loa (eye worm) glutamate-gated chloride channel alpha3A subunit 0.0178 0.0151 0.0147
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0356 0.0372 0.1687
Schistosoma mansoni acetylcholine receptor-related 0.0087 0.0037 0.0029
Schistosoma mansoni nAChR subunit (ShAR1-beta2-like) 0.0178 0.0151 0.0143
Schistosoma mansoni potassium-dependent sodium-calcium exchanger 3 4 0.0204 0.0183 0.0176
Schistosoma mansoni sodium/calcium exchanger 0.8087 1 1
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0731 0.0839 0.4597
Echinococcus granulosus glycine receptor subunit beta 0.0178 0.0151 0.0143
Loa Loa (eye worm) hypothetical protein 0.0178 0.0151 0.0147

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) = 2100 NM Inhibition of growth of murine leukemia (L1210) cells. ChEMBL. 3351855
ILSmax (functional) = 73 % The percentage increase in lifespan of compound with P388 tumor bearing controls when treated at optimal dose ChEMBL. 3351855
ILSmax (functional) = 117 % The percentage increase in lifespan of compound with Lewis lung carcinoma tumor bearing controls when treated at OD ChEMBL. 3351855
Log K (binding) = 5.61 Binding constant for DNA by ethidium bromide displacement ChEMBL. 3351855
Log K (binding) = 5.9 Binding constant for DNA by ethidium bromide displacement ChEMBL. 3351855
OD (functional) = 100 mg kg-1 day-1 Optimal dose following i.p. administration on days 1,5 and 9 after inoculation of 10e6 P388 leukemia cells to mice. ChEMBL. 3351855
OD (functional) = 150 mg kg-1 day-1 Optimal dose of the compound administered intraperitoneally to mice infected with Lewis lung carcinoma cells(LL) in vivo ChEMBL. 3351855
pKa = 2.95 pKa of the compound was evaluated ChEMBL. 3351855

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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