Detailed information for compound 992766

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 395.925 | Formula: C23H26ClN3O
  • H donors: 1 H acceptors: 1 LogP: 3.87 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1cc(nc2c1cccc2)c1ccc(cc1)CNCCCN1CCOCC1
  • InChi: 1S/C23H26ClN3O/c24-21-16-23(26-22-5-2-1-4-20(21)22)19-8-6-18(7-9-19)17-25-10-3-11-27-12-14-28-15-13-27/h1-2,4-9,16,25H,3,10-15,17H2
  • InChiKey: ICDJQQMVCTVASB-UHFFFAOYSA-N  


Substructure search Similarity search

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
Trypanosoma brucei NADPH--cytochrome P450 reductase, putative 0.0108 0.2698 0.8611
Schistosoma mansoni protein tyrosine phosphatase non-receptor type nt1 0.0343 0.9839 1
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.0122 0.3133 0.3185
Trypanosoma brucei 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0044 0.0764 0.2439
Mycobacterium ulcerans formate dehydrogenase H FdhF 0.0108 0.2698 0.6728
Echinococcus multilocularis geminin 0.017 0.4579 0.4654
Trypanosoma cruzi PAS-domain containing phosphoglycerate kinase, putative 0.0027 0.0247 0.0789
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0028 0.0273 0.0273
Trichomonas vaginalis sulfite reductase, putative 0.0108 0.2698 1
Trichomonas vaginalis 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0044 0.0764 0.2833
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0019 0 0.5
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0003 0.001
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0003 0.001
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0793 0.0806
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0019 0.0003 0.0012
Trichomonas vaginalis NADPH cytochrome P450, putative 0.0041 0.0679 0.2517
Echinococcus granulosus single minded 2 0.0077 0.1761 0.1789
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0793 0.0806
Mycobacterium ulcerans putative regulatory protein 0.0077 0.1761 0.439
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0793 0.0806
Loa Loa (eye worm) FAD binding domain-containing protein 0.0108 0.2698 0.2698
Trichomonas vaginalis NADPH cytochrome P450, putative 0.0041 0.0679 0.2517
Plasmodium vivax 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0044 0.0764 0.2833
Brugia malayi flavodoxin family protein 0.0041 0.0679 0.0679
Trypanosoma cruzi Flavodoxin/Radical SAM superfamily/Wyosine base formation, putative 0.0041 0.0679 0.2167
Trichomonas vaginalis conserved hypothetical protein 0.0027 0.0247 0.0917
Echinococcus multilocularis NADPH cytochrome P450 reductase 0.0108 0.2698 0.2742
Trypanosoma cruzi STE group serine/threonine-protein kinase, putative 0.0027 0.0247 0.0789
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0028 0.0273 0.0273
Brugia malayi Putative carbonic anhydrase 5 precursor 0.0122 0.3133 0.3133
Leishmania major protein kinase, putative 0.0027 0.0247 0.0789
Schistosoma mansoni carbonic anhydrase-related 0.0028 0.0273 0.0277
Schistosoma mansoni synaptic glycoprotein sc2 related 0.0044 0.0764 0.0777
Giardia lamblia Synaptic glycoprotein SC2 0.0044 0.0764 0.3285
Trichomonas vaginalis NADPH fad oxidoreductase, putative 0.0096 0.2326 0.8622
Trypanosoma cruzi STE group serine/threonine-protein kinase, putative 0.0027 0.0247 0.0789
Echinococcus multilocularis carbonic anhydrase 0.0028 0.0273 0.0277
Echinococcus granulosus methionine synthase reductase 0.0067 0.1447 0.1471
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0019 0.0003 0.0003
Plasmodium falciparum carbonic anhydrase 0.0028 0.0273 0.1012
Schistosoma mansoni diflavin oxidoreductase 0.0054 0.1051 0.1068
Loa Loa (eye worm) aryl Hydrocarbon receptor Associated protein family member 0.0027 0.0247 0.0247
Entamoeba histolytica type A flavoprotein, putative 0.0041 0.0679 0.8885
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.0343 0.9839 1
Echinococcus granulosus carbonic anhydrase 0.0028 0.0273 0.0277
Echinococcus granulosus dna polymerase kappa 0.0019 0.0003 0.0003
Loa Loa (eye worm) carbonic anhydrase 3 0.0122 0.3133 0.3133
Trypanosoma brucei carbonic anhydrase-like protein 0.0122 0.3133 1
Trichomonas vaginalis guanylate cyclase, putative 0.0027 0.0247 0.0917
Trichomonas vaginalis synaptic glycoprotein sc2, putative 0.0044 0.0764 0.2833
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0019 0.0003 0.0003
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0028 0.0273 0.0273
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0027 0.0247 0.0917
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0049 0.0916 0.0916
Leishmania major p450 reductase, putative 0.0108 0.2698 0.8611
Echinococcus granulosus geminin 0.017 0.4579 0.4654
Echinococcus multilocularis carbonic anhydrase 0.0028 0.0273 0.0277
Mycobacterium ulcerans carboxylesterase, LipT 0.0151 0.401 1
Trypanosoma cruzi STE/STE11 serine/threonine-protein kinase, putative 0.0027 0.0247 0.0789
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.0916 0.0916
Echinococcus granulosus 3 oxo 5 alpha steroid 4 dehydrogenase C terminal 0.0044 0.0764 0.0777
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.0343 0.9839 1
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.0003 0.0003
Entamoeba histolytica type A flavoprotein, putative 0.0041 0.0679 0.8885
Trichomonas vaginalis adenylate cyclase, type VII, putative 0.0027 0.0247 0.0917
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0003 0.001
Schistosoma mansoni single-minded 0.0104 0.2579 0.2622
Giardia lamblia Nitric oxide synthase, inducible 0.0096 0.2326 1
Loa Loa (eye worm) hypothetical protein 0.0019 0.0003 0.0003
Trichomonas vaginalis 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0044 0.0764 0.2833
Brugia malayi 3-oxo-5-alpha-steroid 4-dehydrogenase 1 0.0044 0.0764 0.0764
Mycobacterium ulcerans hypothetical protein 0.0044 0.0764 0.1906
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.0028 0.0273 0.0273
Loa Loa (eye worm) hypothetical protein 0.0028 0.0273 0.0273
Toxoplasma gondii hypothetical protein 0.0028 0.0273 0.2598
Trichomonas vaginalis soluble guanylate cyclase gcy, putative 0.0027 0.0247 0.0917
Trypanosoma cruzi PAS-domain containing phosphoglycerate kinase, putative 0.0027 0.0247 0.0789
Trypanosoma cruzi NADPH-dependent FMN/FAD containing oxidoreductase, putative 0.0108 0.2698 0.8611
Trypanosoma cruzi 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0044 0.0764 0.2439
Schistosoma mansoni terminal deoxycytidyl transferase 0.0019 0.0003 0.0003
Trichomonas vaginalis synaptic glycoprotein sc2, putative 0.0044 0.0764 0.2833
Plasmodium vivax NADPH-cytochrome p450 reductase, putative 0.0108 0.2698 1
Entamoeba histolytica type A flavoprotein, putative 0.0041 0.0679 0.8885
Echinococcus granulosus carbonic anhydrase 0.0028 0.0273 0.0277
Leishmania major protein kinase, putative 0.0027 0.0247 0.0789
Trypanosoma brucei NADPH--cytochrome P450 reductase, putative 0.0108 0.2698 0.8611
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.0122 0.3133 1
Trichomonas vaginalis conserved hypothetical protein 0.0027 0.0247 0.0917
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0003 0.001
Mycobacterium ulcerans DNA polymerase IV 0.0019 0.0003 0.0008
Plasmodium falciparum nitric oxide synthase, putative 0.0108 0.2698 1
Trichomonas vaginalis conserved hypothetical protein 0.0044 0.0764 0.2833
Trypanosoma cruzi STE/STE11 serine/threonine-protein kinase, putative 0.0027 0.0247 0.0789
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0003 0.001
Toxoplasma gondii 3-oxo-5-alpha-steroid 4-dehydrogenase 0.0044 0.0764 0.7274
Trichomonas vaginalis NADPH cytochrome P450, putative 0.0041 0.0679 0.2517
Plasmodium vivax hypothetical protein, conserved 0.0041 0.0679 0.2517
Plasmodium vivax polyprenol reductase, putative 0.0044 0.0764 0.2833
Trichomonas vaginalis DNA polymerase eta, putative 0.0019 0.0003 0.0012
Loa Loa (eye worm) hypothetical protein 0.0349 1 1
Plasmodium falciparum polyprenol reductase, putative 0.0044 0.0764 0.2833
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0003 0.001
Plasmodium falciparum 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0044 0.0764 0.2833
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0003 0.001
Leishmania major carbonic anhydrase-like protein 0.0122 0.3133 1
Brugia malayi flavodoxin family protein 0.0108 0.2698 0.2698
Toxoplasma gondii flavodoxin domain-containing protein 0.0054 0.1051 1
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.0003 0.0003
Trichomonas vaginalis synaptic glycoprotein sc2, putative 0.0044 0.0764 0.2833
Entamoeba histolytica 3-oxo-5-alpha-steroid 4-dehydrogenase domain-containing protein 0.0044 0.0764 1
Echinococcus granulosus Aryl hydrocarbon receptor nuclear 0.0027 0.0247 0.0251
Leishmania major DNA polymerase kappa, putative 0.0019 0.0003 0.001
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0027 0.0247 0.0917
Loa Loa (eye worm) hypothetical protein 0.0108 0.2698 0.2698
Trypanosoma cruzi 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0044 0.0764 0.2439
Trypanosoma cruzi cytochrome P450 reductase, putative 0.0108 0.2698 0.8611
Trichomonas vaginalis conserved hypothetical protein 0.0027 0.0247 0.0917
Toxoplasma gondii 3-oxo-5-alpha-steroid 4-dehydrogenase 0.0044 0.0764 0.7274
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0019 0.0003 0.001
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0027 0.0247 0.0917
Brugia malayi Synaptic glycoprotein SC2 0.0044 0.0764 0.0764
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.0028 0.0273 0.0273
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0445 0.0445
Trypanosoma cruzi Flavodoxin/Radical SAM superfamily/Wyosine base formation, putative 0.0041 0.0679 0.2167
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0003 0.001
Trypanosoma brucei S-adenosyl-L-methionine-dependent tRNA 4-demethylwyosine synthase, putative 0.0041 0.0679 0.2167
Entamoeba histolytica type A flavoprotein, putative 0.0041 0.0679 0.8885
Echinococcus multilocularis dna polymerase eta 0.0019 0.0003 0.0003
Echinococcus multilocularis methionine synthase reductase 0.0067 0.1447 0.1471
Echinococcus multilocularis transfer RNA-Lys 0.0077 0.1761 0.1789
Schistosoma mansoni NADPH flavin oxidoreductase 0.0054 0.1076 0.1093
Schistosoma mansoni carbonic anhydrase 0.0028 0.0273 0.0277
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.0122 0.3133 0.3185
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0003 0.001
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0122 0.3133 0.3133
Echinococcus granulosus carbonic anhydrase 0.0028 0.0273 0.0277
Giardia lamblia DINP protein human, muc B family 0.0019 0.0003 0.0014
Schistosoma mansoni DNA polymerase eta 0.0019 0.0003 0.0003
Brugia malayi PAS domain containing protein 0.0104 0.2579 0.2579
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0003 0.001
Leishmania major NADPH-cytochrome p450 reductase-like protein 0.0108 0.2698 0.8611
Toxoplasma gondii 3-oxo-5-alpha-steroid 4-dehydrogenase 0.0044 0.0764 0.7274
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0003 0.001
Echinococcus multilocularis carbonic anhydrase II 0.0122 0.3133 0.3185
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0793 0.0806
Leishmania major 3-oxo-5-alpha-steroid 4-dehydrogenase-like protein 0.0044 0.0764 0.2439
Trichomonas vaginalis 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0044 0.0764 0.2833
Mycobacterium ulcerans DNA polymerase IV 0.0019 0.0003 0.0008
Mycobacterium tuberculosis Carboxylesterase LipT 0.0151 0.401 1
Entamoeba histolytica type A flavoprotein, putative 0.0041 0.0679 0.8885
Loa Loa (eye worm) hypothetical protein 0.0028 0.0273 0.0273
Echinococcus multilocularis NADPH dependent diflavin oxidoreductase 1 0.0108 0.2698 0.2742
Onchocerca volvulus 0.0077 0.1761 1
Toxoplasma gondii flavodoxin domain-containing protein 0.0054 0.1051 1
Mycobacterium tuberculosis Conserved hypothetical protein 0.0019 0.0003 0.0008
Trichomonas vaginalis guanylate cyclase, putative 0.0027 0.0247 0.0917
Loa Loa (eye worm) hypothetical protein 0.0049 0.0916 0.0916
Schistosoma mansoni hypothetical protein 0.017 0.4579 0.4654
Leishmania major cytochrome P450 reductase, putative 0.0096 0.2326 0.7425
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.0122 0.3133 1
Brugia malayi hypoxia-induced factor 1 0.0322 0.9181 0.9181
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0343 0.9839 0.9839
Brugia malayi bHLH-PAS transcription factor 0.0077 0.1761 0.1761
Entamoeba histolytica deoxycytidyl transferase, putative 0.0019 0.0003 0.0042
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0019 0.0003 0.0008
Trypanosoma cruzi p450 reductase, putative 0.0108 0.2698 0.8611
Loa Loa (eye worm) hypothetical protein 0.0044 0.0764 0.0764
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0003 0.001
Loa Loa (eye worm) hypothetical protein 0.0034 0.0445 0.0445
Schistosoma mansoni hypothetical protein 0.0028 0.0273 0.0277
Echinococcus granulosus NADPH dependent diflavin oxidoreductase 1 0.0108 0.2698 0.2742
Schistosoma mansoni hypothetical protein 0.0034 0.0445 0.0452
Loa Loa (eye worm) FAD binding domain-containing protein 0.0067 0.1447 0.1447
Echinococcus multilocularis aryl hydrocarbon receptor 0.0027 0.0247 0.0251
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0003 0.001
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0003 0.001
Treponema pallidum flavodoxin 0.0041 0.0679 1
Leishmania major PAS-domain containing phosphoglycerate kinase, putative 0.0027 0.0247 0.0789
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.0122 0.3133 0.3133
Loa Loa (eye worm) hypothetical protein 0.0044 0.0764 0.0764
Plasmodium falciparum S-adenosyl-L-methionine-dependent tRNA 4-demethylwyosine synthase, putative 0.0041 0.0679 0.2517
Trypanosoma brucei unspecified product 0.0019 0.0003 0.001
Schistosoma mansoni carbonic anhydrase-related 0.0028 0.0273 0.0277
Echinococcus multilocularis dna polymerase kappa 0.0019 0.0003 0.0003
Echinococcus granulosus carbonic anhydrase II 0.0122 0.3133 0.3185
Onchocerca volvulus 0.0044 0.0764 0.3417
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0793 0.0806
Mycobacterium leprae Possible regulatory protein 0.0027 0.0247 0.5
Trypanosoma cruzi 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0044 0.0764 0.2439
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0019 0.0003 0.0003
Entamoeba histolytica trans-2,3-enoyl-CoA reductase, putative 0.0044 0.0764 1
Loa Loa (eye worm) flavodoxin family protein 0.0041 0.0679 0.0679
Leishmania major hypothetical protein, conserved 0.0041 0.0679 0.2167
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0793 0.0806
Entamoeba histolytica hypothetical protein 0.0044 0.0764 1
Leishmania major DNA polymerase eta, putative 0.0019 0.0003 0.001
Trypanosoma brucei 3-oxo-5-alpha-steroid 4-dehydrogenase-like, putative 0.0044 0.0764 0.2439
Schistosoma mansoni carbonic anhydrase-related 0.0028 0.0273 0.0277
Brugia malayi FAD binding domain containing protein 0.0067 0.1447 0.1447
Trichomonas vaginalis 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0044 0.0764 0.2833
Echinococcus multilocularis Aryl hydrocarbon receptor nuclear 0.0027 0.0247 0.0251
Schistosoma mansoni cytochrome P450 reductase 0.0108 0.2698 0.2742
Plasmodium falciparum NADPH--cytochrome P450 reductase, putative 0.0041 0.0679 0.2517
Trichomonas vaginalis NADPH cytochrome P450, putative 0.0041 0.0679 0.2517
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0793 0.0806
Echinococcus multilocularis 3 oxo 5 alpha steroid 4 dehydrogenase, C terminal 0.0044 0.0764 0.0777
Trypanosoma cruzi cytochrome P450 reductase, putative 0.0108 0.2698 0.8611
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0019 0.0003 0.0003
Echinococcus multilocularis carbonic anhydrase 0.0028 0.0273 0.0277
Entamoeba histolytica steroid 5-alpha reductase, putative 0.0044 0.0764 1
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0045 0.0793 0.0793
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0003 0.001
Giardia lamblia Hypothetical protein 0.0096 0.2326 1
Plasmodium vivax flavodoxin domain containing protein 0.0096 0.2326 0.8622
Echinococcus granulosus aryl hydrocarbon receptor 0.0027 0.0247 0.0251
Echinococcus granulosus synaptic glycoprotein sc2 0.0044 0.0764 0.0777
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.0916 0.0916
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0045 0.0793 0.0793
Brugia malayi FAD binding domain containing protein 0.0108 0.2698 0.2698
Chlamydia trachomatis sulfite reductase 0.0067 0.1447 1
Echinococcus granulosus dna polymerase eta 0.0019 0.0003 0.0003
Trichomonas vaginalis conserved hypothetical protein 0.0044 0.0764 0.2833
Trypanosoma brucei NADPH-cytochrome p450 reductase, putative 0.0108 0.2698 0.8611
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0003 0.001
Schistosoma mansoni 5-methyl tetrahydrofolate-homocysteine methyltransferase reductase 0.0067 0.1447 0.1471
Trypanosoma brucei DNA polymerase eta, putative 0.0019 0.0003 0.001
Schistosoma mansoni hypothetical protein 0.017 0.4579 0.4654
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0343 0.9839 0.9839
Trypanosoma brucei NADPH-dependent diflavin oxidoreductase 1 0.0108 0.2698 0.8611
Trypanosoma cruzi DNA polymerase eta, putative 0.0019 0.0003 0.001
Loa Loa (eye worm) hypothetical protein 0.0044 0.0764 0.0764
Echinococcus multilocularis synaptic glycoprotein sc2 0.0044 0.0764 0.0777
Loa Loa (eye worm) hypoxia-induced factor 1 0.0322 0.9181 0.9181
Schistosoma mansoni synaptic glycoprotein sc2 related 0.0044 0.0764 0.0777
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.0028 0.0273 0.0273
Loa Loa (eye worm) hypothetical protein 0.0028 0.0273 0.0273
Echinococcus granulosus NADPH cytochrome P450 reductase 0.0108 0.2698 0.2742
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0003 0.001
Schistosoma mansoni aryl hydrocarbon receptor 0.0104 0.2579 0.2622
Loa Loa (eye worm) hypothetical protein 0.0027 0.0247 0.0247
Trypanosoma cruzi NADPH--cytochrome P450 reductase, putative 0.0041 0.0679 0.2167
Trichomonas vaginalis adenylate cyclase, putative 0.0027 0.0247 0.0917

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) = 21.1 uM Cytotoxicity against human NCI-H460 cells after 48 hrs by MTT assay ChEMBL. 20554355
IC50 (ADMET) = 22.4 uM Cytotoxicity against HUVEC cells after 48 hrs by MTT assay ChEMBL. 20554355
IC50 (functional) = 31.5 uM Inhibition of HUVEC cell adhesion to collagen at 15 uM after 1 hr ChEMBL. 20554355
Inhibition (functional) = 58.9 % Inhibition of HUVEC cell adhesion to collagen at 30 uM after 1 hr ChEMBL. 20554355
Inhibition (functional) = 67.8 % Inhibition of HUVEC cell adhesion to collagen at 15 uM after 3 hrs ChEMBL. 20554355
Inhibition (functional) = 69.4 % Inhibition of HUVEC cell adhesion to collagen at 30 uM after 3 hrs ChEMBL. 20554355
Inhibition (functional) = 72.3 % Inhibition of migration of HUVEC cellss at 15 to 30 uM ChEMBL. 20554355

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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