Detailed information for compound 1648711

Basic information

Technical information
  • TDR Targets ID: 1648711
  • Name: 1-di(propan-2-yloxy)phosphoryl-N'-(2-hydroxye thyl)-N-[(4-nitrophenyl)amino]methanimidamide
  • MW: 388.356 | Formula: C15H25N4O6P
  • H donors: 3 H acceptors: 4 LogP: 2.53 Rotable bonds: 11
    Rule of 5 violations (Lipinski): 1
  • SMILES: OCCN/C(=N\Nc1ccc(cc1)[N+](=O)[O-])/P(=O)(OC(C)C)OC(C)C
  • InChi: 1S/C15H25N4O6P/c1-11(2)24-26(23,25-12(3)4)15(16-9-10-20)18-17-13-5-7-14(8-6-13)19(21)22/h5-8,11-12,17,20H,9-10H2,1-4H3,(H,16,18)
  • InChiKey: KYYFLYIYFJNJMX-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 1-diisopropoxyphosphoryl-N'-(2-hydroxyethyl)-N-[(4-nitrophenyl)amino]formamidine
  • AIDS-140391
  • AIDS140391
  • Diisopropyl ((2-hydroxyethyl)amino)-4-(hydroxy(oxido)amino)benzohydrazonoylphosphonate
  • NSC652146
  • NCI60_018252

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
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0235 0.8908 1
Loa Loa (eye worm) beta-lactamase 0.0037 0.1088 0.1084
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.1531 0.1527
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0262 1 1
Loa Loa (eye worm) DR-78 0.0124 0.4525 0.4523
Schistosoma mansoni nuclear hormone receptor 0.0262 1 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.1531 0.1527
Onchocerca volvulus 0.0037 0.1088 0.0911
Loa Loa (eye worm) hypothetical protein 0.0124 0.4525 0.4523
Schistosoma mansoni coup transcription factor 0.0262 1 1
Schistosoma mansoni hypothetical protein 0.0033 0.0926 0.0109
Brugia malayi MH2 domain containing protein 0.0122 0.4449 0.4449
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0124 0.4525 0.4523
Loa Loa (eye worm) hypothetical protein 0.0262 1 1
Brugia malayi orphan nuclear receptor NR2E1 0.0124 0.4525 0.4525
Echinococcus multilocularis lysosomal alpha glucosidase 0.0171 0.6385 0.6383
Loa Loa (eye worm) hypothetical protein 0.0139 0.5111 0.5109
Trichomonas vaginalis D-aminoacylase, putative 0.0037 0.1088 0.9508
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0262 1 1
Loa Loa (eye worm) nuclear receptor NHR-67 0.0124 0.4525 0.4523
Brugia malayi ecdysone receptor 0.0124 0.4525 0.4525
Schistosoma mansoni alpha-glucosidase 0.0147 0.5445 0.5035
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0033 0.0926 0.0926
Brugia malayi Nuclear hormone receptor E75 0.0124 0.4525 0.4525
Loa Loa (eye worm) hypothetical protein 0.0124 0.4525 0.4523
Onchocerca volvulus Bile acid receptor homolog 0.0262 1 1
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0139 0.5111 0.5109
Onchocerca volvulus 0.0037 0.1088 0.0911
Echinococcus multilocularis beta LACTamase domain containing family member 0.0037 0.1088 0.1084
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0262 1 1
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0262 1 1
Brugia malayi nuclear hormone receptor 0.0124 0.4525 0.4525
Brugia malayi nuclear receptor RXR 0.0124 0.4525 0.4525
Loa Loa (eye worm) hypothetical protein 0.0262 1 1
Schistosoma mansoni nuclear receptor 0.0124 0.4525 0.4032
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0124 0.4525 0.4523
Echinococcus multilocularis ecdysone induced protein 78C 0.0262 1 1
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0124 0.4525 0.4525
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0262 1 1
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0038 0.1134 1
Loa Loa (eye worm) hypothetical protein 0.0037 0.1088 0.1084
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0124 0.4525 0.4523
Brugia malayi nuclear hormone receptor family member nhr-6 0.0124 0.4525 0.4525
Loa Loa (eye worm) hypothetical protein 0.0037 0.1088 0.1084
Brugia malayi photoreceptor-specific nuclear receptor 0.0262 1 1
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0262 1 1
Loa Loa (eye worm) hypothetical protein 0.0037 0.1088 0.1084
Brugia malayi Nuclear hormone receptor-like 1 0.0139 0.5111 0.5111
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0124 0.4525 0.4032
Echinococcus multilocularis lysosomal alpha glucosidase 0.0171 0.6385 0.6383
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0262 1 1
Trichomonas vaginalis alpha-glucosidase, putative 0.0038 0.1134 1
Loa Loa (eye worm) hypothetical protein 0.0124 0.4525 0.4523
Trichomonas vaginalis sucrase-isomaltase, putative 0.0038 0.1134 1
Schistosoma mansoni cpg binding protein 0.0032 0.0894 0.0074
Schistosoma mansoni nuclear hormone receptor 0.0124 0.4525 0.4032
Loa Loa (eye worm) hypothetical protein 0.0014 0.0194 0.019
Mycobacterium ulcerans esterase/lipase LipP 0.0037 0.1088 0.5
Brugia malayi Calcitonin receptor-like protein seb-1 0.0103 0.3711 0.3711
Brugia malayi Nuclear hormone receptor-like 1 0.0262 1 1
Echinococcus multilocularis GPCR, family 2 0.0033 0.0926 0.0921
Schistosoma mansoni steroid hormone receptor ad4bp 0.0262 1 1
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0262 1 1
Loa Loa (eye worm) hypothetical protein 0.0139 0.5111 0.5109
Loa Loa (eye worm) hypothetical protein 0.0037 0.1088 0.1084
Schistosoma mansoni cpg binding protein 0.0032 0.0894 0.0074
Schistosoma mansoni alpha-glucosidase 0.0147 0.5445 0.5035
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0038 0.1134 1
Leishmania major alpha glucosidase II subunit, putative 0.0038 0.1134 1
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0033 0.0926 0.0921
Schistosoma mansoni hypothetical protein 0.0033 0.0926 0.0109
Trypanosoma cruzi hypothetical protein, conserved 0.0037 0.1088 0.9508
Loa Loa (eye worm) latrophilin receptor protein 2 0.0033 0.0926 0.0921
Brugia malayi Glycosyl hydrolases family 31 protein 0.0038 0.1134 0.1134
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0037 0.1088 0.0285
Loa Loa (eye worm) transcription factor SMAD2 0.0122 0.4449 0.4446
Trichomonas vaginalis alpha-glucosidase, putative 0.0038 0.1134 1
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0038 0.1134 1
Trichomonas vaginalis alpha-glucosidase, putative 0.0038 0.1134 1
Echinococcus granulosus beta LACTamase domain containing family member 0.0037 0.1088 0.1084
Brugia malayi hypothetical protein 0.0139 0.5111 0.5111
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0262 1 1
Loa Loa (eye worm) hypothetical protein 0.0124 0.4525 0.4523
Schistosoma mansoni nuclear receptor 0.0124 0.4525 0.4032
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0139 0.5111 0.5109
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0124 0.4525 0.4523
Loa Loa (eye worm) hypothetical protein 0.0262 1 1
Brugia malayi Latrophilin receptor protein 2 0.0033 0.0926 0.0926
Trichomonas vaginalis alpha-glucosidase, putative 0.0038 0.1134 1
Mycobacterium ulcerans lipase LipD 0.0037 0.1088 0.5
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0124 0.4525 0.4523
Loa Loa (eye worm) hypothetical protein 0.0124 0.4525 0.4523
Loa Loa (eye worm) hypothetical protein 0.0124 0.4525 0.4523
Schistosoma mansoni hypothetical protein 0.0033 0.0926 0.0109
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0037 0.1088 0.5
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.1531 0.1527
Brugia malayi latrophilin 2 splice variant baaae 0.0071 0.2422 0.2422
Loa Loa (eye worm) CXXC zinc finger family protein 0.003 0.0826 0.0822
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0262 1 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0037 0.1088 0.9508
Brugia malayi Glycosyl hydrolases family 31 protein 0.0171 0.6385 0.6385
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0262 1 1
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0262 1 1
Brugia malayi steroid hormone receptor 0.0262 1 1
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0033 0.0926 0.0921
Loa Loa (eye worm) hypothetical protein 0.0124 0.4525 0.4523
Loa Loa (eye worm) hypothetical protein 0.0124 0.4525 0.4523
Brugia malayi nuclear receptor NHR-88 0.0124 0.4525 0.4525
Brugia malayi Nuclear hormone receptor-like 1 0.0139 0.5111 0.5111
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0103 0.3711 0.3708
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0124 0.4525 0.4417
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0124 0.4525 0.4523
Trichomonas vaginalis penicillin-binding protein, putative 0.0037 0.1088 0.9508
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0262 1 1
Brugia malayi nuclear receptor RXR 0.0139 0.5111 0.5111
Plasmodium vivax hypothetical protein, conserved 0.0037 0.1088 0.5
Trypanosoma brucei hypothetical protein, conserved 0.0037 0.1088 0.9508
Loa Loa (eye worm) hypothetical protein 0.0262 1 1
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0038 0.1134 1
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0124 0.4525 0.4417
Brugia malayi CXXC zinc finger family protein 0.003 0.0826 0.0826
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0048 0.1531 0.1527
Loa Loa (eye worm) hypothetical protein 0.0037 0.1088 0.1084
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0262 1 1
Echinococcus granulosus cpg binding protein 0.0032 0.0894 0.089
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0037 0.1088 0.1084
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0124 0.4525 0.4523
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0033 0.0926 0.0921
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0262 1 1
Onchocerca volvulus 0.0124 0.4525 0.4417
Loa Loa (eye worm) hypothetical protein 0.0262 1 1
Loa Loa (eye worm) hypothetical protein 0.0033 0.0926 0.0921
Onchocerca volvulus 0.0099 0.354 0.3412
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0262 1 1
Schistosoma mansoni thyroid hormone receptor 0.0262 1 1
Brugia malayi Nuclear hormone receptor E75 0.0124 0.4525 0.4525
Trypanosoma brucei glucosidase, putative 0.0038 0.1134 1
Echinococcus granulosus Nuclear hormone receptor HR96 0.0124 0.4525 0.4523
Loa Loa (eye worm) hypothetical protein 0.0124 0.4525 0.4523
Loa Loa (eye worm) hypothetical protein 0.0037 0.1088 0.1084
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.1134 1
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0262 1 1
Echinococcus granulosus Nuclear hormone receptor HR96 0.0124 0.4525 0.4523
Onchocerca volvulus Protein ultraspiracle homolog 0.0262 1 1
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0262 1 1
Brugia malayi nuclear hormone receptor 0.0262 1 1
Loa Loa (eye worm) hypothetical protein 0.0139 0.5111 0.5109
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.1531 0.0769
Loa Loa (eye worm) hypothetical protein 0.0124 0.4525 0.4523
Onchocerca volvulus 0.0262 1 1
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0038 0.1134 0.113
Brugia malayi hypothetical protein 0.0124 0.4525 0.4525
Mycobacterium leprae Probable lipase LipE 0.0037 0.1088 0.5
Echinococcus granulosus lysosomal alpha glucosidase 0.0171 0.6385 0.6383
Loa Loa (eye worm) hypothetical protein 0.0124 0.4525 0.4523
Loa Loa (eye worm) hypothetical protein 0.0139 0.5111 0.5109
Loa Loa (eye worm) hypothetical protein 0.0262 1 1
Onchocerca volvulus 0.0124 0.4525 0.4417
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0139 0.5111 0.4671
Schistosoma mansoni nuclear hormone receptor 0.0124 0.4525 0.4032
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0139 0.5111 0.5109
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0262 1 1
Trypanosoma cruzi hypothetical protein, conserved 0.0037 0.1088 0.9508
Trichomonas vaginalis esterase, putative 0.0037 0.1088 0.9508
Schistosoma mansoni hypothetical protein 0.0071 0.2422 0.1739
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0064 0.216 0.1454
Brugia malayi beta-lactamase 0.0037 0.1088 0.1088
Schistosoma mansoni hypothetical protein 0.0033 0.0926 0.0109
Echinococcus granulosus ecdysone induced protein 78C 0.0262 1 1
Loa Loa (eye worm) hypothetical protein 0.0103 0.3711 0.3708
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0262 1 1
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0171 0.6385 0.6383
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0262 1 1
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0262 1 1
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0124 0.4525 0.4032
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0262 1 1
Echinococcus granulosus GPCR family 2 0.0033 0.0926 0.0921
Echinococcus multilocularis nuclear receptor nhr 48 0.0124 0.4525 0.4523
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0037 0.1088 0.0285
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0262 1 1
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0262 1 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0262 1 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0048 0.1531 0.1531
Brugia malayi Steroid receptor seven-up type 2 0.0262 1 1
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0262 1 1
Echinococcus granulosus nuclear receptor nhr 48 0.0124 0.4525 0.4523
Echinococcus granulosus thyroid hormone receptor alpha 0.0124 0.4525 0.4523
Brugia malayi nuclear hormone receptor family member odr-7 0.0124 0.4525 0.4525
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.1531 0.0769
Loa Loa (eye worm) hypothetical protein 0.0124 0.4525 0.4523
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0262 1 1
Echinococcus multilocularis thyroid hormone receptor alpha 0.0262 1 1
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0262 1 1
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0262 1 1
Brugia malayi hypothetical protein 0.0139 0.5111 0.5111
Echinococcus multilocularis neutral alpha glucosidase AB 0.0038 0.1134 0.113
Echinococcus multilocularis FTZ F1 alpha 0.0262 1 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0262 1 1
Mycobacterium ulcerans hypothetical protein 0.0037 0.1088 0.5
Brugia malayi nuclear receptor NHR-88 0.0262 1 1
Loa Loa (eye worm) hypothetical protein 0.0124 0.4525 0.4523
Brugia malayi beta-lactamase family protein 0.0037 0.1088 0.1088
Brugia malayi beta-lactamase family protein 0.0037 0.1088 0.1088
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0262 1 1
Loa Loa (eye worm) hypothetical protein 0.0071 0.2422 0.2418
Brugia malayi hypothetical protein 0.0124 0.4525 0.4525
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0037 0.1088 0.1088
Schistosoma mansoni retinoic acid receptor RXR 0.0262 1 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0103 0.3711 0.3711
Schistosoma mansoni zinc finger protein 0.0124 0.4525 0.4032
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0038 0.1134 0.0576
Loa Loa (eye worm) hypothetical protein 0.0139 0.5111 0.5109
Onchocerca volvulus 0.003 0.0826 0.0644
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0033 0.0926 0.0921
Mycobacterium ulcerans beta-lactamase 0.0037 0.1088 0.5
Loa Loa (eye worm) nuclear hormone receptor 0.0124 0.4525 0.4523
Brugia malayi nuclear receptor NHR-67 0.0124 0.4525 0.4525
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0262 1 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.1531 0.0769
Echinococcus granulosus FTZ F1 alpha 0.0262 1 1
Echinococcus granulosus neutral alpha glucosidase AB 0.0038 0.1134 0.113
Trichomonas vaginalis alpha-glucosidase, putative 0.0038 0.1134 1
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0262 1 1
Trichomonas vaginalis maltase-glucoamylase, putative 0.0038 0.1134 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0262 1 1
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.1134 1
Brugia malayi conserved hypotetical protein 0.0124 0.4525 0.4525
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.1531 0.1527
Loa Loa (eye worm) hypothetical protein 0.0262 1 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0262 1 1
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0262 1 1
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0262 1 1
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0262 1 1
Schistosoma mansoni RAR-like nuclear receptor 0.0262 1 1
Trichomonas vaginalis D-aminoacylase, putative 0.0037 0.1088 0.9508
Schistosoma mansoni alpha glucosidase 0.0038 0.1134 0.0336
Echinococcus multilocularis cpg binding protein 0.0032 0.0894 0.089
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0262 1 1
Brugia malayi Glycosyl hydrolases family 31 protein 0.0014 0.0194 0.0194
Loa Loa (eye worm) hypothetical protein 0.0262 1 1
Schistosoma mansoni thyroid hormone receptor 0.0262 1 1
Trichomonas vaginalis D-aminoacylase, putative 0.0037 0.1088 0.9508
Brugia malayi tailless protein 0.0124 0.4525 0.4525
Loa Loa (eye worm) MH2 domain-containing protein 0.0122 0.4449 0.4446
Leishmania major hypothetical protein, conserved 0.0037 0.1088 0.9508
Toxoplasma gondii histone lysine methyltransferase SET1 0.0057 0.189 1
Schistosoma mansoni nuclear receptor nhr-48 0.0124 0.4525 0.4032
Loa Loa (eye worm) steroid hormone receptor 0.0262 1 1
Onchocerca volvulus 0.0037 0.1088 0.0911
Mycobacterium leprae conserved hypothetical protein 0.0037 0.1088 0.5
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0139 0.5111 0.4671
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0124 0.4525 0.4523

Activities

Activity type Activity value Assay description Source Reference
GI50 (functional) -4.37 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
GI50 (functional) -4.267 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) -4.193 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) -4 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) -4 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) -4 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) -4 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

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.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

No literature references available for this target.

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