Detailed information for compound 207151

Basic information

Technical information
  • TDR Targets ID: 207151
  • Name: N-phenyl-2-pyridin-4-ylquinazolin-4-amine
  • MW: 298.341 | Formula: C19H14N4
  • H donors: 1 H acceptors: 3 LogP: 4.01 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: c1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccncc1
  • InChi: 1S/C19H14N4/c1-2-6-15(7-3-1)21-19-16-8-4-5-9-17(16)22-18(23-19)14-10-12-20-13-11-14/h1-13H,(H,21,22,23)
  • InChiKey: CUGSTOYIMVAMHZ-UHFFFAOYSA-N  


Substructure search Similarity search

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Synonyms

  • N-phenyl-2-(4-pyridyl)quinazolin-4-amine
  • N-phenyl-2-(4-pyridyl)-4-quinazolinamine
  • N-phenyl-2-pyridin-4-yl-quinazolin-4-amine
  • phenyl-[2-(4-pyridyl)quinazolin-4-yl]amine
  • ZINC00521614
  • MLS000590783
  • Phenyl-(2-pyridin-4-yl-quinazolin-4-yl)-amine
  • SMR000219221
  • STOCK3S-84976

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens phosphodiesterase 5A, cGMP-specific Starlite/ChEMBL References
Escherichia coli penicillin-binding protein Starlite/ChEMBL No references
Homo sapiens chromobox homolog 1 Starlite/ChEMBL No references
Homo sapiens survival of motor neuron 2, centromeric Starlite/ChEMBL No references
Homo sapiens GNAS complex locus Starlite/ChEMBL No references
Homo sapiens ATPase family, AAA domain containing 5 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Schistosoma mansoni camp/cgmp cyclic nucleotide phosphodiesterase Get druggable targets OG5_127318 All targets in OG5_127318
Echinococcus granulosus dual 3'5' cyclic AMP and GMP phosphodiesterase Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Leishmania donovani cAMP specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Schistosoma japonicum Chromobox protein homolog 5, putative Get druggable targets OG5_129545 All targets in OG5_129545
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trypanosoma cruzi cAMP specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Leishmania braziliensis cAMP specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Leishmania infantum cAMP specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trypanosoma congolense cAMP-specific phosphodiesterase Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_132873 All targets in OG5_132873
Trypanosoma cruzi cAMP specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis chromobox protein, putative Get druggable targets OG5_129545 All targets in OG5_129545
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Trichomonas vaginalis chromobox protein, putative Get druggable targets OG5_129545 All targets in OG5_129545
Loa Loa (eye worm) heterochromatin protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Mycobacterium tuberculosis Possible penicillin-binding protein Get druggable targets OG5_149948 All targets in OG5_149948
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_129545 All targets in OG5_129545
Trypanosoma cruzi cAMP specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Echinococcus granulosus survival motor neuron protein 1 Get druggable targets OG5_132873 All targets in OG5_132873
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Schistosoma japonicum Dual 3',5'-cyclic-AMP and -GMP phosphodiesterase 11, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis cGMP-inhibited 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Theileria parva hypothetical protein Get druggable targets OG5_129545 All targets in OG5_129545
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Schistosoma japonicum Dual 3',5'-cyclic-AMP and -GMP phosphodiesterase 11, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis cAMP/cGMP cyclic nucleotide phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trypanosoma brucei cAMP-specific phosphodiesterase Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Echinococcus granulosus chromobox protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Trypanosoma cruzi cAMP specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Schistosoma japonicum expressed protein Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trypanosoma brucei cAMP-specific phosphodiesterase Get druggable targets OG5_127318 All targets in OG5_127318
Candida albicans similar to S. cerevisiae PDE2 (YOR360C) cAMP phosphodiesterase Get druggable targets OG5_127318 All targets in OG5_127318
Leishmania braziliensis cAMP specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127318 All targets in OG5_127318
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain Get druggable targets OG5_131088 All targets in OG5_131088
Brugia malayi hypothetical protein Get druggable targets OG5_132873 All targets in OG5_132873
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis chromobox protein, putative Get druggable targets OG5_129545 All targets in OG5_129545
Schistosoma japonicum Dual 3',5'-cyclic-AMP and -GMP phosphodiesterase 11, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis chromobox protein, putative Get druggable targets OG5_129545 All targets in OG5_129545
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Candida albicans similar to S. cerevisiae PDE2 (YOR360C) cAMP phosphodiesterase Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Echinococcus multilocularis dual 3',5' cyclic AMP and GMP phosphodiesterase Get druggable targets OG5_127318 All targets in OG5_127318
Onchocerca volvulus Get druggable targets OG5_129545 All targets in OG5_129545
Trypanosoma congolense cAMP-specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Echinococcus granulosus chromobox protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative Get druggable targets OG5_131088 All targets in OG5_131088
Brugia malayi Heterochromatin protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Trypanosoma brucei gambiense cAMP-specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Onchocerca volvulus Heterochromatin protein 1 homolog Get druggable targets OG5_129545 All targets in OG5_129545
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core Get druggable targets OG5_139225 All targets in OG5_139225
Echinococcus multilocularis chromobox protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Schistosoma mansoni chromobox protein Get druggable targets OG5_129545 All targets in OG5_129545
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative Get druggable targets OG5_131088 All targets in OG5_131088
Leishmania infantum cAMP specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Leishmania mexicana cAMP specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Schistosoma mansoni chromobox protein Get druggable targets OG5_129545 All targets in OG5_129545
Echinococcus multilocularis chromobox protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Echinococcus multilocularis survival motor neuron protein 1 Get druggable targets OG5_132873 All targets in OG5_132873
Toxoplasma gondii hypothetical protein Get druggable targets OG5_127318 All targets in OG5_127318
Leishmania mexicana cAMP specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trypanosoma brucei gambiense cAMP-specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127318 All targets in OG5_127318
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Schistosoma mansoni GTP-binding protein alpha subunit gna GNAS complex locus 394 aa 450 aa 28.7 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) hypothetical protein 0.0043 0.0097 0.0097
Brugia malayi beta-lactamase family protein 0.0043 0.0097 0.0097
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0074 0.0365 0.0274
Brugia malayi ERG2 and Sigma1 receptor like protein 0.1147 0.9887 0.9887
Plasmodium vivax hypothetical protein, conserved 0.0043 0.0097 0.5
Trichomonas vaginalis glucosylceramidase, putative 0.0216 0.1625 0.6555
Onchocerca volvulus 0.0058 0.0228 0.0189
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.0076 0.0076
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0074 0.0365 0.1473
Mycobacterium leprae Probable lipase LipE 0.0043 0.0097 0.5
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0074 0.0365 0.1473
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.005 0.0157 0.0633
Trichomonas vaginalis glucosylceramidase, putative 0.0216 0.1625 0.6555
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0074 0.0365 0.1473
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0074 0.0365 0.1473
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.005 0.0157 0.0061
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0074 0.0365 0.1473
Trichomonas vaginalis conserved hypothetical protein 0.0047 0.013 0.0524
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0097 0.0097
Echinococcus multilocularis chromobox protein 1 0.0084 0.0458 0.0458
Loa Loa (eye worm) hypothetical protein 0.0043 0.0097 0.0097
Schistosoma mansoni hypothetical protein 0.0058 0.0228 0.0228
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.1527 0.6161
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0074 0.0365 0.1473
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0201 0.0201
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.0245 0.0245
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0074 0.0365 0.1473
Trichomonas vaginalis conserved hypothetical protein 0.0047 0.013 0.0524
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.2478 1
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0043 0.0097 0.0097
Loa Loa (eye worm) hypothetical protein 0.0047 0.013 0.013
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0043 0.0097 0.0097
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0074 0.0365 0.1473
Trichomonas vaginalis chromobox protein, putative 0.0051 0.0162 0.0652
Loa Loa (eye worm) hypothetical protein 0.0037 0.0039 0.0039
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative 0.0074 0.0365 0.1473
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.0097 0.0392
Echinococcus multilocularis beta LACTamase domain containing family member 0.0043 0.0097 0.0097
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0201 0.0201
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0074 0.0365 0.1473
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0043 0.0097 0.5
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0047 0.013 0.0091
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.0245 0.0245
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0074 0.0365 0.1473
Trichomonas vaginalis cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative 0.005 0.0157 0.0633
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0043 0.0097 0.0097
Entamoeba histolytica hypothetical protein 0.0043 0.0097 0.5
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0051 0.0162 0.0123
Schistosoma mansoni chromobox protein 0.0084 0.0458 0.0458
Trichomonas vaginalis chromobox protein, putative 0.0084 0.0458 0.1847
Loa Loa (eye worm) hypothetical protein 0.0586 0.4912 0.4912
Onchocerca volvulus 0.0043 0.0097 0.0058
Loa Loa (eye worm) vesicular acetylcholine transporter unc-17 0.116 1 1
Echinococcus multilocularis vesicular acetylcholine transporter 0.116 1 1
Trichomonas vaginalis conserved hypothetical protein 0.0065 0.0285 0.1149
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0074 0.0365 0.1473
Trichomonas vaginalis chromobox protein, putative 0.0051 0.0162 0.0652
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0074 0.0365 0.1473
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0278 0.2176 1
Schistosoma mansoni chromobox protein 0.0084 0.0458 0.0458
Echinococcus granulosus chromobox protein 1 0.0084 0.0458 0.0458
Trichomonas vaginalis cAMP/cGMP cyclic nucleotide phosphodiesterase, putative 0.0074 0.0365 0.1473
Trichomonas vaginalis conserved hypothetical protein 0.0033 0.0008 0.0031
Brugia malayi hypothetical protein 0.0286 0.2245 0.2245
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.1527 0.6161
Schistosoma mansoni hypothetical protein 0.0043 0.0097 0.0097
Echinococcus multilocularis dual 3',5' cyclic AMP and GMP phosphodiesterase 0.0074 0.0365 0.0365
Loa Loa (eye worm) hypothetical protein 0.0041 0.0076 0.0076
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0097 0.0392
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.2478 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0201 0.0201
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0074 0.0365 0.1473
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.0201 0.0201
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.1527 0.6161
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0043 0.0097 0.0097
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0097 0.0392
Echinococcus granulosus dual 3'5' cyclic AMP and GMP phosphodiesterase 0.0074 0.0365 0.0365
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0058 0.0228 0.0228
Entamoeba histolytica hypothetical protein 0.0043 0.0097 0.5
Trypanosoma cruzi C-8 sterol isomerase, putative 0.1147 0.9887 1
Mycobacterium ulcerans beta-lactamase 0.0043 0.0097 0.5
Mycobacterium ulcerans hypothetical protein 0.0043 0.0097 0.5
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0074 0.0365 0.1473
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.0312 0.2478 0.2478
Trichomonas vaginalis cGMP-inhibited 3,5-cyclic phosphodiesterase, putative 0.0074 0.0365 0.1473
Onchocerca volvulus Vesicular acetylcholine transporter homolog 0.116 1 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.0201 0.0201
Schistosoma mansoni transcription factor LCR-F1 0.0043 0.0097 0.0097
Schistosoma mansoni camp/cgmp cyclic nucleotide phosphodiesterase 0.0074 0.0365 0.0365
Loa Loa (eye worm) hypothetical protein 0.0043 0.0097 0.0097
Loa Loa (eye worm) hypothetical protein 0.1147 0.9887 0.9887
Loa Loa (eye worm) beta-lactamase 0.0043 0.0097 0.0097
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0074 0.0365 0.1473
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.1527 0.6161
Leishmania major C-8 sterol isomerase-like protein 0.1147 0.9887 1
Trichomonas vaginalis conserved hypothetical protein 0.0074 0.0365 0.1473
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0201 0.0201
Onchocerca volvulus 0.0043 0.0097 0.0058
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative 0.0074 0.0365 0.1473
Toxoplasma gondii hypothetical protein 0.0065 0.0285 1
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0979 0.8399 0.8399
Trypanosoma brucei cAMP-specific phosphodiesterase 0.0074 0.0365 0.0274
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0074 0.0365 0.1473
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.1527 0.6161
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0074 0.0365 0.1473
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0097 0.0097
Brugia malayi beta-lactamase 0.0043 0.0097 0.0097
Loa Loa (eye worm) hypothetical protein 0.0043 0.0097 0.0097
Loa Loa (eye worm) hypothetical protein 0.0043 0.0097 0.0097
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0074 0.0365 0.0274
Schistosoma mansoni hypothetical protein 0.0041 0.0076 0.0076
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0074 0.0365 0.1473
Entamoeba histolytica hypothetical protein 0.0043 0.0097 0.5
Brugia malayi Heterochromatin protein 1 0.0084 0.0458 0.0458
Echinococcus granulosus survival motor neuron protein 1 0.0286 0.2245 0.2245
Schistosoma mansoni survival motor neuron protein 0.0058 0.0228 0.0228
Echinococcus multilocularis chromobox protein 1 0.0084 0.0458 0.0458
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0097 0.0392
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0201 0.0201
Trypanosoma brucei C-8 sterol isomerase, putative 0.1147 0.9887 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0201 0.0201
Loa Loa (eye worm) heterochromatin protein 1 0.0084 0.0458 0.0458
Trichomonas vaginalis chromobox protein, putative 0.0084 0.0458 0.1847
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.0245 0.0245
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.0097 0.0392
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0074 0.0365 0.1473
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.2478 1
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.2478 1
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0249 0.1925 0.1925
Echinococcus granulosus beta LACTamase domain containing family member 0.0043 0.0097 0.0097
Echinococcus multilocularis survival motor neuron protein 1 0.0286 0.2245 0.2245
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.2478 1
Mycobacterium leprae conserved hypothetical protein 0.0043 0.0097 0.5
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.1527 0.6161
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0074 0.0365 0.1473
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0074 0.0365 0.1473
Trichomonas vaginalis conserved hypothetical protein 0.0065 0.0285 0.1149
Trypanosoma brucei cAMP-specific phosphodiesterase 0.0074 0.0365 0.0274
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0074 0.0365 0.0274
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.0312 0.2478 0.2478
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0201 0.0201
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.2478 1
Echinococcus granulosus chromobox protein 1 0.0084 0.0458 0.0458
Onchocerca volvulus 0.0043 0.0097 0.0058
Mycobacterium ulcerans lipase LipD 0.0043 0.0097 0.5
Entamoeba histolytica hypothetical protein 0.0043 0.0097 0.5
Trichomonas vaginalis esterase, putative 0.0043 0.0097 0.0392
Loa Loa (eye worm) hypothetical protein 0.0286 0.2245 0.2245
Schistosoma mansoni vesicular acetylcholine transporter 0.116 1 1
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0074 0.0365 0.1473
Mycobacterium ulcerans esterase/lipase LipP 0.0043 0.0097 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0033 0.0008 0.0031
Trichomonas vaginalis conserved hypothetical protein 0.0065 0.0285 0.1149
Echinococcus granulosus vesicular acetylcholine transporter 0.116 1 1
Brugia malayi follicle stimulating hormone receptor 0.0249 0.1925 0.1925
Brugia malayi hypothetical protein 0.0043 0.0097 0.0097
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.1527 0.6161
Loa Loa (eye worm) hypothetical protein 0.006 0.0245 0.0245
Brugia malayi beta-lactamase family protein 0.0043 0.0097 0.0097
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0074 0.0365 0.1473
Loa Loa (eye worm) hypothetical protein 0.0043 0.0097 0.0097
Onchocerca volvulus Glucosylceramidase homolog 0.0205 0.1527 0.1493
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0074 0.0365 0.1473
Brugia malayi chromobox protein homolog 3 0.0047 0.013 0.013

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 1.2 uM Inhibitory activity against phosphodiesterase 5 from human platelets ChEMBL. 7658441
IC50 (binding) = 1.2 uM Inhibitory activity against phosphodiesterase 5 from human platelets ChEMBL. 7658441
Potency (functional) 2.0596 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125] ChEMBL. No reference
Potency (functional) 8.9125 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference
Potency (functional) 10.4179 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 11.2202 uM PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 12.5893 um PUBCHEM_BIOASSAY: qHTS Assay for Enhancers of SMN2 Splice Variant Expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 15.8489 um PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))] ChEMBL. No reference
Potency (binding) 25.1189 uM PubChem BioAssay. qHTS Assay for Inhibitors of MBNL1-poly(CUG) RNA binding. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 31.6228 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase). (Class of assay: confirmatory) [Related pubchem assays: 2429 (Confirmation qHTS Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase)), 2407 (Probe Development Summary for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase)), 2427 (Thermal Shift Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase))] ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human Jumonji Domain Containing 2E (JMJD2E). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))] ChEMBL. No reference
Potency (functional) = 39.8107 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of DNA Polymerase Beta. (Class of assay: confirmatory) ChEMBL. No reference
Potency (binding) = 50.1187 um PUBCHEM_BIOASSAY: qHTS Assay for Identification of Novel General Anesthetics. In this assay, a GABAergic mimetic model system, apoferritin and a profluorescent 1-aminoanthracene ligand (1-AMA), was used to construct a competitive binding assay for identification of novel general anesthetics (Class of assay: confirmatory) [Related pubchem assays: 2385 (Probe Development Summary for Identification of Novel General Anesthetics), 2323 (Validation apoferritin assay run on SigmaAldrich LOPAC1280 collection)] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

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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