Detailed information for compound 1622216

Basic information

Technical information
  • TDR Targets ID: 1622216
  • Name: N,N'-bis(1-nitroacridin-9-yl)propane-1,3-diam ine
  • MW: 518.523 | Formula: C29H22N6O4
  • H donors: 2 H acceptors: 6 LogP: 6.81 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 2
  • SMILES: [O-][N+](=O)c1cccc2c1c(NCCCNc1c3ccccc3nc3c1c(ccc3)[N+](=O)[O-])c1c(n2)cccc1
  • InChi: 1S/C29H22N6O4/c36-34(37)24-14-5-12-22-26(24)28(18-8-1-3-10-20(18)32-22)30-16-7-17-31-29-19-9-2-4-11-21(19)33-23-13-6-15-25(27(23)29)35(38)39/h1-6,8-15H,7,16-17H2,(H,30,32)(H,31,33)
  • InChiKey: SWTNGUJPNWBOQC-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-hydroxy-9-[3-[[1-(hydroxy-oxidoazaniumyl)acridin-9-yl]amino]propylamino]acridin-1-amine oxide
  • N-[9-[3-[[1-(hydroxy-oxidoamino)acridin-9-yl]amino]propylamino]acridin-1-yl]-N-oxidohydroxylamine
  • N-hydroxy-9-[3-[[1-(hydroxy-oxido-ammonio)acridin-9-yl]amino]propylamino]acridin-1-amine oxide
  • N-[9-[3-[[1-(hydroxy-oxido-amino)acridin-9-yl]amino]propylamino]acridin-1-yl]-N-oxido-hydroxylamine
  • N-[9-[3-[[1-(hydroxy-oxidoamino)-9-acridinyl]amino]propylamino]-1-acridinyl]-N-oxidohydroxylamine
  • N,N'-bis(1-nitro-9-acridinyl)propane-1,3-diamine
  • N-hydroxy-9-[3-[[1-(hydroxy-oxidoammonio)-9-acridinyl]amino]propylamino]-1-acridinamine oxide
  • (1-nitroacridin-9-yl)-[3-[(1-nitroacridin-9-yl)amino]propyl]amine
  • N-hydroxy-9-[3-[[1-(hydroxy-oxido-azaniumyl)acridin-9-yl]amino]propylamino]acridin-1-amine oxide
  • NCIMech_000699
  • 1-(Hydroxy(oxido)amino)-9-((3-((1-(hydroxy(oxido)amino)-9-acridinyl)amino)propyl)amino)acridine
  • AIDS-151157
  • AIDS151157
  • NSC690634
  • NCI60_032532

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 neurogenic locus protein delta 0.0133 0.028 0.1119
Trypanosoma brucei retrotransposon hot spot protein 4 (RHS4), interrupted 0.0125 0.0223 0.007
Schistosoma mansoni Pro-neuregulin-4 membrane-bound isoform (Pro-NRG4) [Contains: Neuregulin-4 (NRG-4)] 0.0133 0.028 0.0786
Loa Loa (eye worm) hypothetical protein 0.0238 0.1022 0.2873
Echinococcus multilocularis nicotinic acetylcholine receptor beta 1 subunit 0.0238 0.1022 0.409
Schistosoma mansoni family A2 unassigned peptidase (A02 family) 0.0478 0.2725 0.766
Schistosoma mansoni nAChR subunit 0.011 0.0117 0.0329
Schistosoma mansoni hypothetical protein 0.0133 0.028 0.0786
Loa Loa (eye worm) hypothetical protein 0.0596 0.3558 1
Brugia malayi hypothetical protein 0.011 0.0117 0.0329
Schistosoma mansoni acetylcholine receptor subunit beta 0.011 0.0117 0.0329
Schistosoma mansoni notch 0.0133 0.028 0.0786
Loa Loa (eye worm) nicotinic acetylcholine receptor alpha subunit 0.0446 0.2499 0.7025
Brugia malayi Calcium binding EGF domain containing protein 0.0133 0.028 0.0786
Trypanosoma brucei ingi protein (ORF1) 0.0125 0.0223 0.007
Loa Loa (eye worm) transcription factor SMAD2 0.012 0.0188 0.053
Echinococcus multilocularis glycine receptor subunit beta 0.0238 0.1022 0.409
Echinococcus multilocularis fibrillin 1 0.0347 0.18 0.7201
Echinococcus granulosus neurogenic locus notch protein 0.0133 0.028 0.1119
Loa Loa (eye worm) hypothetical protein 0.011 0.0117 0.0329
Echinococcus multilocularis protein jagged 1 0.0133 0.028 0.1119
Plasmodium vivax cysteine repeat modular protein 1, putative 0.014 0.0335 0.5
Echinococcus multilocularis nicotinic acetylcholine receptor subunit alpha 8 0.0446 0.2499 1
Loa Loa (eye worm) hypothetical protein 0.011 0.0117 0.0329
Brugia malayi acetylcholine receptor, alpha-type subunit unc-38 precursor 0.0238 0.1022 0.2873
Brugia malayi Kringle domain containing protein 0.014 0.0335 0.0941
Loa Loa (eye worm) ligand-Gated ion Channel family member 0.0238 0.1022 0.2873
Loa Loa (eye worm) hypothetical protein 0.0133 0.028 0.0786
Loa Loa (eye worm) low-density lipoprotein receptor repeat class B containing protein 0.0347 0.18 0.5059
Echinococcus granulosus tyrosine protein kinase Btk29A 0.03 0.1461 0.5845
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.011 0.0117 0.0329
Schistosoma mansoni slit 0.0133 0.028 0.0786
Echinococcus granulosus nAChR subunit 0.0128 0.0247 0.0989
Brugia malayi nicotinic acetylcholine receptor alpha subunit, putative 0.0446 0.2499 0.7025
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0238 0.1022 0.2873
Echinococcus multilocularis protein jagged 2 0.0133 0.028 0.1119
Loa Loa (eye worm) hypothetical protein 0.0238 0.1022 0.2873
Leishmania major hypothetical protein, conserved 0.014 0.0335 1
Toxoplasma gondii PAN domain-containing protein 0.0687 0.4201 1
Onchocerca volvulus 0.011 0.0117 0.0329
Brugia malayi GCC2 and GCC3 family protein 0.0133 0.028 0.0786
Schistosoma mansoni phosphoglucomutase 0.0115 0.0154 0.0432
Loa Loa (eye worm) nicotinic acetylcholine receptor non-alpha subunit 0.0238 0.1022 0.2873
Loa Loa (eye worm) hypothetical protein 0.0133 0.028 0.0786
Echinococcus granulosus glycine receptor subunit alpha 1 0.0238 0.1022 0.409
Loa Loa (eye worm) hypothetical protein 0.0133 0.028 0.0786
Trypanosoma brucei hypothetical protein, conserved 0.0125 0.0223 0.007
Loa Loa (eye worm) hypothetical protein 0.011 0.0117 0.0329
Loa Loa (eye worm) hypothetical protein 0.011 0.0117 0.0329
Onchocerca volvulus Neurogenic locus notch protein homolog 0.0133 0.028 0.0786
Loa Loa (eye worm) hypothetical protein 0.0133 0.028 0.0786
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0238 0.1022 0.2873
Loa Loa (eye worm) hypothetical protein 0.0128 0.0247 0.0694
Echinococcus granulosus glycine receptor subunit alpha 1 0.0238 0.1022 0.409
Brugia malayi glutamate-gated chloride channel alpha3A subunit, putative 0.011 0.0117 0.0329
Schistosoma mansoni intracisternal A-particle retropepsin (A02 family) 0.0478 0.2725 0.766
Trypanosoma cruzi hypothetical protein, conserved 0.014 0.0335 1
Loa Loa (eye worm) hypothetical protein 0.0133 0.028 0.0786
Loa Loa (eye worm) hypothetical protein 0.011 0.0117 0.0329
Echinococcus granulosus neurogenic locus notch protein 4 0.0133 0.028 0.1119
Schistosoma mansoni nAChR subunit 0.011 0.0117 0.0329
Schistosoma mansoni laminin gamma-3 chain 0.0133 0.028 0.0786
Onchocerca volvulus 0.0133 0.028 0.0786
Echinococcus granulosus neurogenic locus protein delta 0.0133 0.028 0.1119
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0238 0.1022 0.2873
Onchocerca volvulus 0.0596 0.3558 1
Brugia malayi hypothetical protein 0.011 0.0117 0.0329
Brugia malayi EGF-like domain containing protein 0.0133 0.028 0.0786
Brugia malayi Hypothetical glycine receptor like protein T20B12.9 in chromosome III 0.0238 0.1022 0.2873
Loa Loa (eye worm) hypothetical protein 0.011 0.0117 0.0329
Loa Loa (eye worm) hypothetical protein 0.0133 0.028 0.0786
Loa Loa (eye worm) hypothetical protein 0.011 0.0117 0.0329
Echinococcus granulosus glycine receptor subunit beta 0.0238 0.1022 0.409
Brugia malayi EGF-like domain containing protein 0.0133 0.028 0.0786
Schistosoma mansoni nAChR subunit 0.0238 0.1022 0.2873
Brugia malayi EGF-like domain containing protein 0.0133 0.028 0.0786
Brugia malayi Delta serrate ligand family protein 0.0133 0.028 0.0786
Loa Loa (eye worm) hypothetical protein 0.0238 0.1022 0.2873
Brugia malayi EGF-like domain containing protein 0.0133 0.028 0.0786
Mycobacterium ulcerans hypothetical protein 0.0093 0 0.5
Echinococcus granulosus tissue type plasminogen activator 0.014 0.0335 0.134
Brugia malayi Cation transporter family protein 0.0596 0.3558 1
Loa Loa (eye worm) excitatory GABA receptor EXP-1A 0.0238 0.1022 0.2873
Toxoplasma gondii kringle domain-containing protein 0.014 0.0335 0.0447
Echinococcus granulosus nicotinic acetylcholine receptor subunit alpha 8 0.0446 0.2499 1
Onchocerca volvulus Neurogenic locus notch homolog 0.0133 0.028 0.0786
Brugia malayi notch-like transmembrane receptor 0.0133 0.028 0.0786
Loa Loa (eye worm) hypothetical protein 0.0133 0.028 0.0786
Schistosoma mansoni notch 0.0133 0.028 0.0786
Echinococcus granulosus nicotinic acetylcholine receptor alpha subunit 0.0446 0.2499 1
Schistosoma mansoni hypothetical protein 0.0133 0.028 0.0786
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0238 0.1022 0.409
Loa Loa (eye worm) hypothetical protein 0.0133 0.028 0.0786
Loa Loa (eye worm) hypothetical protein 0.0238 0.1022 0.2873
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.011 0.0117 0.0329
Brugia malayi gamma-aminobutyric-acid receptor beta subunit precursor 0.0238 0.1022 0.2873
Loa Loa (eye worm) hypothetical protein 0.0347 0.18 0.5059
Brugia malayi Calcium binding EGF domain containing protein 0.0347 0.18 0.5059
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0128 0.0247 0.0694
Schistosoma mansoni nAChR subunit 0.0238 0.1022 0.2873
Loa Loa (eye worm) hypothetical protein 0.0238 0.1022 0.2873
Onchocerca volvulus 0.0238 0.1022 0.2873
Echinococcus granulosus delta-like protein 1 0.0133 0.028 0.1119
Schistosoma mansoni acetylcholine receptor-related 0.011 0.0117 0.0329
Schistosoma mansoni nAChR subunit 0.0238 0.1022 0.2873
Echinococcus granulosus Cys loop ligand gated ion channel subunit 0.011 0.0117 0.0468
Echinococcus granulosus neuronal acetylcholine receptor subunit alpha 4 0.0238 0.1022 0.409
Loa Loa (eye worm) hypothetical protein 0.0347 0.18 0.5059
Schistosoma mansoni cell polarity protein 0.0133 0.028 0.0786
Loa Loa (eye worm) hypothetical protein 0.011 0.0117 0.0329
Plasmodium falciparum cysteine repeat modular protein 1 0.014 0.0335 0.5
Onchocerca volvulus 0.011 0.0117 0.0329
Loa Loa (eye worm) hypothetical protein 0.011 0.0117 0.0329
Loa Loa (eye worm) LGC-31 protein 0.0238 0.1022 0.2873
Echinococcus granulosus gamma aminobutyric acid receptor subunit 0.011 0.0117 0.0468
Loa Loa (eye worm) hypothetical protein 0.0133 0.028 0.0786
Loa Loa (eye worm) ACC-1 protein 0.0238 0.1022 0.2873
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0238 0.1022 0.2873
Loa Loa (eye worm) hypothetical protein 0.0128 0.0247 0.0694
Echinococcus granulosus glycine receptor subunit alpha 1 0.0238 0.1022 0.409
Loa Loa (eye worm) hypothetical protein 0.0128 0.0247 0.0694
Entamoeba histolytica hypothetical protein 0.0128 0.0247 0.5
Brugia malayi RNase H family protein 0.0115 0.0154 0.0432
Onchocerca volvulus Putative cubilin 0.0133 0.028 0.0786
Loa Loa (eye worm) hypothetical protein 0.0238 0.1022 0.2873
Echinococcus multilocularis neurogenic locus notch protein 0.0133 0.028 0.1119
Schistosoma mansoni phosphoglucomutase 0.0115 0.0154 0.0432
Brugia malayi hypothetical protein 0.011 0.0117 0.0329
Schistosoma mansoni nAChR subunit 0.0238 0.1022 0.2873
Brugia malayi hypothetical protein 0.011 0.0117 0.0329
Brugia malayi Calcium binding EGF domain containing protein 0.0133 0.028 0.0786
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0238 0.1022 0.2873
Loa Loa (eye worm) acetylcholine receptor protein 0.011 0.0117 0.0329
Schistosoma mansoni nAChR subunit (ShAR1-beta-like) 0.0596 0.3558 1
Loa Loa (eye worm) hypothetical protein 0.0133 0.028 0.0786
Schistosoma mansoni nAChR subunit 0.0238 0.1022 0.2873
Loa Loa (eye worm) hypothetical protein 0.0133 0.028 0.0786
Loa Loa (eye worm) hypothetical protein 0.0238 0.1022 0.2873
Echinococcus multilocularis glycine receptor subunit beta 0.0238 0.1022 0.409
Brugia malayi Cation transporter family protein 0.0238 0.1022 0.2873
Schistosoma mansoni subfamily M12A unassigned peptidase (M12 family) 0.0347 0.18 0.5059
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0238 0.1022 0.409
Loa Loa (eye worm) hypothetical protein 0.0128 0.0247 0.0694
Echinococcus granulosus laminin 0.0347 0.18 0.7201
Schistosoma mansoni hypothetical protein 0.0133 0.028 0.0786
Brugia malayi hypothetical protein 0.011 0.0117 0.0329
Echinococcus multilocularis nicotinic acetylcholine receptor a11 subunit 0.0446 0.2499 1
Echinococcus multilocularis fibropellin Ia 0.0133 0.028 0.1119
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0229 0.0964 0.5
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0128 0.0247 0.0694
Loa Loa (eye worm) glutamate-gated chloride channel alpha3A subunit 0.0238 0.1022 0.2873
Schistosoma mansoni phosphoglucomutase 0.0115 0.0154 0.0432
Onchocerca volvulus Slit protein homolog 0.0133 0.028 0.0786
Brugia malayi Hypothetical glycine receptor like protein T20B12.9 in chromosome III 0.0128 0.0247 0.0694
Echinococcus multilocularis laminin 0.0347 0.18 0.7201
Onchocerca volvulus 0.0238 0.1022 0.2873
Brugia malayi Calcium binding EGF domain containing protein 0.0133 0.028 0.0786
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0238 0.1022 0.2873
Loa Loa (eye worm) hypothetical protein 0.011 0.0117 0.0329
Loa Loa (eye worm) hypothetical protein 0.0238 0.1022 0.2873
Echinococcus multilocularis tissue type plasminogen activator 0.014 0.0335 0.134
Onchocerca volvulus 0.0133 0.028 0.0786
Brugia malayi EGF-like domain containing protein 0.0133 0.028 0.0786
Schistosoma mansoni egf-like domain protein 0.0347 0.18 0.5059
Toxoplasma gondii calcium binding egf domain-containing protein 0.0347 0.18 0.4067
Echinococcus granulosus neurogenic locus notch protein 0.0133 0.028 0.1119
Onchocerca volvulus 0.0238 0.1022 0.2873
Loa Loa (eye worm) hypothetical protein 0.0238 0.1022 0.2873
Loa Loa (eye worm) hypothetical protein 0.0133 0.028 0.0786
Schistosoma mansoni hypothetical protein 0.0133 0.028 0.0786
Onchocerca volvulus 0.0596 0.3558 1
Echinococcus granulosus glycine receptor subunit beta 0.0238 0.1022 0.409
Loa Loa (eye worm) glutamate-gated chloride channel alpha3A subunit 0.011 0.0117 0.0329
Onchocerca volvulus 0.011 0.0117 0.0329
Brugia malayi EGF-like domain containing protein 0.0133 0.028 0.0786
Brugia malayi Cation transporter family protein 0.0238 0.1022 0.2873
Brugia malayi EGF-like domain containing protein 0.0133 0.028 0.0786
Loa Loa (eye worm) hypothetical protein 0.0238 0.1022 0.2873
Brugia malayi Transmembrane cell adhesion receptor mua-3 precursor, putative 0.0133 0.028 0.0786
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0238 0.1022 0.2873
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0238 0.1022 0.2873
Loa Loa (eye worm) hypothetical protein 0.0347 0.18 0.5059
Loa Loa (eye worm) hypothetical protein 0.0347 0.18 0.5059
Onchocerca volvulus 0.0133 0.028 0.0786
Echinococcus granulosus slit 2 protein 0.0133 0.028 0.1119
Echinococcus granulosus notch 0.0133 0.028 0.1119
Schistosoma mansoni notch 0.0133 0.028 0.0786
Loa Loa (eye worm) hypothetical protein 0.0133 0.028 0.0786
Loa Loa (eye worm) hypothetical protein 0.011 0.0117 0.0329
Loa Loa (eye worm) hypothetical protein 0.0133 0.028 0.0786
Echinococcus granulosus Tolloid protein 1 0.0347 0.18 0.7201
Schistosoma mansoni notch 0.0133 0.028 0.0786
Brugia malayi Fibulin-1 precursor 0.0347 0.18 0.5059
Giardia lamblia High cysteine protein 0.0133 0.028 1
Loa Loa (eye worm) MH2 domain-containing protein 0.012 0.0188 0.053
Echinococcus multilocularis fat cadherin tumor suppressor 0.0133 0.028 0.1119
Loa Loa (eye worm) bone morphogenetic protein 1b 0.0347 0.18 0.5059
Loa Loa (eye worm) hypothetical protein 0.0133 0.028 0.0786
Loa Loa (eye worm) hypothetical protein 0.0486 0.2783 0.7821
Echinococcus granulosus nicotinic acetylcholine receptor subunit type 0.0238 0.1022 0.409
Loa Loa (eye worm) hypothetical protein 0.011 0.0117 0.0329
Loa Loa (eye worm) hypothetical protein 0.0238 0.1022 0.2873
Schistosoma mansoni hypothetical protein 0.0133 0.028 0.0786
Trypanosoma brucei unspecified product 0.0125 0.0223 0.007
Schistosoma mansoni neurotransmitter gated ion channel 0.0128 0.0247 0.0694
Loa Loa (eye worm) hypothetical protein 0.0238 0.1022 0.2873
Echinococcus granulosus protein jagged 2 0.0133 0.028 0.1119
Onchocerca volvulus 0.0128 0.0247 0.0694
Loa Loa (eye worm) hypothetical protein 0.0133 0.028 0.0786
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.011 0.0117 0.0329
Onchocerca volvulus 0.0128 0.0247 0.0694
Brugia malayi Muscle positioning protein 4 0.0133 0.028 0.0786
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0238 0.1022 0.2873
Loa Loa (eye worm) ACC-1 protein 0.0238 0.1022 0.2873
Brugia malayi excitatory GABA receptor EXP-1A 0.0238 0.1022 0.2873
Echinococcus multilocularis nicotinic acetylcholine receptor subunit type 0.011 0.0117 0.0468
Schistosoma mansoni notch 0.0133 0.028 0.0786
Schistosoma mansoni neurotransmitter gated ion channel 0.011 0.0117 0.0329
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0128 0.0247 0.0694
Toxoplasma gondii EGF family domain-containing protein 0.0133 0.028 0.0311
Brugia malayi Low-density lipoprotein receptor repeat class B containing protein 0.0347 0.18 0.5059
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0238 0.1022 0.2873
Echinococcus multilocularis neuronal acetylcholine receptor subunit alpha 4 0.0238 0.1022 0.409
Schistosoma mansoni hypothetical protein 0.014 0.0335 0.0941
Echinococcus granulosus Cys loop ligand gated ion channel subunit 0.0238 0.1022 0.409
Echinococcus multilocularis Cys loop ligand gated ion channel subunit 0.0238 0.1022 0.409
Onchocerca volvulus 0.0133 0.028 0.0786
Loa Loa (eye worm) hypothetical protein 0.0238 0.1022 0.2873
Loa Loa (eye worm) hypothetical protein 0.0128 0.0247 0.0694
Loa Loa (eye worm) hypothetical protein 0.011 0.0117 0.0329
Echinococcus multilocularis tyrosine protein kinase Btk29A 0.03 0.1461 0.5845
Echinococcus multilocularis slit 2 protein 0.0133 0.028 0.1119
Loa Loa (eye worm) hypothetical protein 0.0133 0.028 0.0786
Echinococcus granulosus fibropellin Ia 0.0133 0.028 0.1119
Schistosoma mansoni hypothetical protein 0.043 0.2387 0.6709
Loa Loa (eye worm) hypothetical protein 0.0133 0.028 0.0786
Loa Loa (eye worm) hypothetical protein 0.011 0.0117 0.0329
Toxoplasma gondii calcium binding egf domain-containing protein 0.0347 0.18 0.4067
Schistosoma mansoni neurotransmitter gated ion channel 0.011 0.0117 0.0329
Echinococcus multilocularis nAChR subunit 0.0238 0.1022 0.409
Loa Loa (eye worm) acetylcholine receptor alpha subunit 0.0238 0.1022 0.2873
Echinococcus multilocularis Cys loop ligand gated ion channel subunit 0.011 0.0117 0.0468
Echinococcus multilocularis neurogenic locus notch protein 4 0.0133 0.028 0.1119
Schistosoma mansoni tyrosine kinase 0.0294 0.1423 0.4
Echinococcus granulosus nicotinic acetylcholine receptor a11 subunit 0.0446 0.2499 1
Brugia malayi glutamate-gated chloride channel alpha3A subunit, putative 0.0128 0.0247 0.0694
Echinococcus multilocularis nAChR subunit 0.0128 0.0247 0.0989
Echinococcus multilocularis acetylcholine receptor subunit beta 1 0.0238 0.1022 0.409
Echinococcus granulosus ribonuclease H1 0.0115 0.0154 0.0616
Echinococcus multilocularis ribonuclease H1 0.0115 0.0154 0.0616
Brugia malayi acetylcholine receptor alpha subunit precursor, putative 0.0238 0.1022 0.2873
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0238 0.1022 0.2873
Brugia malayi Neuronal acetylcholine receptor protein, alpha-2 chain precursor 0.011 0.0117 0.0329
Echinococcus multilocularis protein jagged 1 0.0133 0.028 0.1119
Onchocerca volvulus 0.014 0.0335 0.0941
Loa Loa (eye worm) multiple epidermal growth factor-like domains 6 0.0347 0.18 0.5059
Echinococcus multilocularis notch 0.0133 0.028 0.1119
Schistosoma mansoni notch 0.0133 0.028 0.0786
Echinococcus granulosus acetylcholine receptor subunit beta 1 0.0238 0.1022 0.409
Echinococcus multilocularis neurogenic locus notch protein 0.0133 0.028 0.1119
Loa Loa (eye worm) hypothetical protein 0.0133 0.028 0.0786
Brugia malayi Protein kinase domain containing protein 0.0142 0.0346 0.0971
Schistosoma mansoni nAChR subunit (ShAR1-alpha-like) 0.0596 0.3558 1
Echinococcus granulosus protein jagged 1 0.0133 0.028 0.1119
Echinococcus multilocularis neural cadherin 0.0133 0.028 0.1119
Loa Loa (eye worm) hypothetical protein 0.0133 0.028 0.0786
Loa Loa (eye worm) hypothetical protein 0.0128 0.0247 0.0694
Onchocerca volvulus Arrow homolog 0.0347 0.18 0.5059
Brugia malayi Acetylcholine receptor protein, alpha-like chain 1 precursor 0.011 0.0117 0.0329
Echinococcus granulosus nicotinic acetylcholine receptor beta 1 subunit 0.0238 0.1022 0.409
Onchocerca volvulus Ribonuclease H1 homolog 0.0115 0.0154 0.0432
Loa Loa (eye worm) notch protein 0.0133 0.028 0.0786
Echinococcus granulosus neural cadherin 0.0133 0.028 0.1119
Loa Loa (eye worm) hypothetical protein 0.0596 0.3558 1
Loa Loa (eye worm) hypothetical protein 0.0128 0.0247 0.0694
Loa Loa (eye worm) hypothetical protein 0.0238 0.1022 0.2873
Schistosoma mansoni nAChR subunit (ShAR1-beta2-like) 0.0238 0.1022 0.2873
Schistosoma mansoni nicotinic acetylcholine receptor alpha 0.0128 0.0247 0.0694
Onchocerca volvulus 0.0596 0.3558 1
Treponema pallidum ribonuclease H (rnhA) 0.0115 0.0154 0.5
Echinococcus granulosus protein jagged 1 0.0133 0.028 0.1119
Echinococcus multilocularis Tolloid protein 1 0.0347 0.18 0.7201
Schistosoma mansoni nAChR subunit 0.0238 0.1022 0.2873
Loa Loa (eye worm) TK/ROR protein kinase 0.0142 0.0346 0.0971
Echinococcus multilocularis nicotinic acetylcholine receptor alpha subunit 0.0446 0.2499 1
Loa Loa (eye worm) hypothetical protein 0.014 0.0335 0.0941
Loa Loa (eye worm) hypothetical protein 0.0238 0.1022 0.2873
Loa Loa (eye worm) hypothetical protein 0.011 0.0117 0.0329
Trichomonas vaginalis ribonuclease H1, putative 0.0115 0.0154 0.5
Loa Loa (eye worm) GABA receptor subunit 0.0128 0.0247 0.0694
Echinococcus multilocularis gamma aminobutyric acid receptor subunit 0.011 0.0117 0.0468
Schistosoma mansoni hypothetical protein 0.0133 0.028 0.0786
Toxoplasma gondii PAN domain-containing protein 0.0687 0.4201 1
Loa Loa (eye worm) Notch2 0.0133 0.028 0.0786
Trypanosoma brucei ingi protein (ORF1) 0.0125 0.0223 0.007
Schistosoma mansoni nAChR subunit 0.0238 0.1022 0.2873
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0238 0.1022 0.409
Loa Loa (eye worm) hypothetical protein 0.0128 0.0247 0.0694
Loa Loa (eye worm) hypothetical protein 0.0238 0.1022 0.2873
Wolbachia endosymbiont of Brugia malayi ribonuclease HI 0.0115 0.0154 0.5
Echinococcus granulosus nAChR subunit 0.0238 0.1022 0.409
Schistosoma mansoni septate junction protein 0.0133 0.028 0.0786
Loa Loa (eye worm) hypothetical protein 0.0347 0.18 0.5059
Brugia malayi RNase H family protein 0.0115 0.0154 0.0432
Echinococcus granulosus protein jagged 2 0.0133 0.028 0.1119
Schistosoma mansoni hypothetical protein 0.0133 0.028 0.0786
Loa Loa (eye worm) hypothetical protein 0.0133 0.028 0.0786
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0238 0.1022 0.2873
Brugia malayi acetylcholine receptor protein, alpha-like chain, putative 0.0238 0.1022 0.2873
Loa Loa (eye worm) hypothetical protein 0.0133 0.028 0.0786
Brugia malayi nicotinic acetylcholine receptor beta-1 chain precursor 0.0238 0.1022 0.2873
Onchocerca volvulus Putative nachr subunit 0.0446 0.2499 0.7025
Brugia malayi Cadherin domain containing protein 0.0133 0.028 0.0786
Echinococcus multilocularis neurogenic locus protein delta 0.0133 0.028 0.1119
Brugia malayi MH2 domain containing protein 0.012 0.0188 0.053
Loa Loa (eye worm) hypothetical protein 0.0446 0.2499 0.7025
Brugia malayi RNase H family protein 0.0115 0.0154 0.0432
Onchocerca volvulus 0.0133 0.028 0.0786
Brugia malayi Cadherin domain containing protein 0.0133 0.028 0.0786
Loa Loa (eye worm) neuronal acetylcholine receptor protein 0.011 0.0117 0.0329

Activities

Activity type Activity value Assay description Source Reference
GI50 (functional) -8 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HOP-92 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -7.916 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the ACHN Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -7.91 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MDA-N Breast cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -7.794 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SF-539 Central Nervous System cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -7.789 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SK-MEL-5 Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -7.785 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the DU-145 Prostate cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -7.772 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SN12C Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -7.74 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the NCI-H23 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -7.423 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MALME-3M Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -7.326 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the UO-31 Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -6.919 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HL-60(TB) Leukemia cell line. (Class of assay: confirmatory) ChEMBL. No reference

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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