Detailed information for compound 30604

Basic information

Technical information
  • TDR Targets ID: 30604
  • Name: benzyl N-[(2S)-3-oxo-1-phenylbutan-2-yl]carba mate
  • MW: 297.348 | Formula: C18H19NO3
  • H donors: 1 H acceptors: 2 LogP: 3.18 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(N[C@H](C(=O)C)Cc1ccccc1)OCc1ccccc1
  • InChi: 1S/C18H19NO3/c1-14(20)17(12-15-8-4-2-5-9-15)19-18(21)22-13-16-10-6-3-7-11-16/h2-11,17H,12-13H2,1H3,(H,19,21)/t17-/m0/s1
  • InChiKey: XKRFOEGCACICFY-KRWDZBQOSA-N  


Substructure search Similarity search

Network

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Synonyms

  • benzyl N-[(1S)-1-benzyl-2-oxo-propyl]carbamate
  • N-[(1S)-1-benzyl-2-oxopropyl]carbamic acid benzyl ester
  • phenylmethyl N-[(2S)-3-oxo-1-phenyl-butan-2-yl]carbamate
  • N-[(1S)-1-benzyl-2-keto-propyl]carbamic acid benzyl ester
  • phenylmethyl N-[(2S)-3-oxo-1-phenylbutan-2-yl]carbamate
  • phenylmethyl N-[(1S)-2-oxo-1-(phenylmethyl)propyl]carbamate
  • N-[(1S)-2-oxo-1-(phenylmethyl)propyl]carbamic acid phenylmethyl ester
  • N-[(1S)-1-(benzyl)-2-keto-propyl]carbamic acid benzyl ester

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni jumonji/arid domain-containing protein 0.0061 0.0634 0.0634
Loa Loa (eye worm) calcium/calmodulin-stimulated cyclic nucleotide phosphodiesterase 0.0329 0.4544 0.4543
Brugia malayi jmjC domain containing protein 0.0061 0.0634 0.059
Schistosoma mansoni hypothetical protein 0.0172 0.226 0.226
Brugia malayi 3'5'-cyclic nucleotide phosphodiesterase family protein 0.0301 0.4143 0.4115
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative 0.0282 0.3871 0.869
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0322 0.4444 1
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0282 0.3871 0.8843
Loa Loa (eye worm) hypothetical protein 0.0176 0.2313 0.2311
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0137 0.1751 0.2413
Loa Loa (eye worm) hypothetical protein 0.0026 0.0126 0.0124
Trypanosoma cruzi cyclic nucleotide phosphodiesterase 0.0137 0.1751 0.3656
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0057 0.058 0.0536
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0137 0.1751 0.3848
Loa Loa (eye worm) hypothetical protein 0.0191 0.2543 0.2542
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0137 0.1751 0.2413
Mycobacterium leprae Probable adenosine deaminase Add (ADENOSINE AMINOHYDROLASE) 0.026 0.355 1
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0137 0.1751 0.3848
Trichomonas vaginalis set domain proteins, putative 0.0244 0.331 0.7409
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.0334 0.463 0.4605
Trypanosoma cruzi AMP deaminase, putative 0.0085 0.0988 0.1789
Plasmodium vivax adenosine/AMP deaminase, putative 0.0085 0.0988 0.2191
Trichomonas vaginalis adenosine deaminase, putative 0.026 0.355 0.7958
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0282 0.3871 0.869
Leishmania major hypothetical protein, conserved 0.0137 0.1751 0.3656
Brugia malayi PAS domain containing protein 0.0072 0.0798 0.0755
Echinococcus multilocularis high affinity cAMP specific 3',5' cyclic 0.0137 0.1751 0.1712
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0214 0.2878 0.2876
Brugia malayi Bloom's syndrome protein homolog 0.0022 0.0066 0.002
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0026 0.0126 0.0227
Brugia malayi hypoxia-induced factor 1 0.0155 0.2013 0.1975
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0212 0.2847 0.6351
Toxoplasma gondii Adenosine/AMP deaminase domain-containing protein 0.026 0.355 0.521
Leishmania major hypothetical protein, conserved 0.0085 0.0988 0.1789
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0026 0.0126 0.008
Trypanosoma cruzi AMP deaminase, putative 0.0085 0.0988 0.1789
Trichomonas vaginalis conserved hypothetical protein 0.0035 0.0257 0.0435
Loa Loa (eye worm) jmjC domain-containing protein 0.0061 0.0634 0.0632
Brugia malayi ecdysteroid receptor 0.0026 0.0126 0.008
Plasmodium falciparum LCCL domain-containing protein 0.002 0.0047 0.0053
Schistosoma mansoni survival motor neuron protein 0.005 0.0475 0.0475
Toxoplasma gondii AMP deaminase 0.0085 0.0988 0.1227
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0137 0.1751 0.1751
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0026 0.0126 0.0124
Mycobacterium leprae Possible regulatory protein 0.0035 0.0257 0.0594
Echinococcus granulosus bloom syndrome protein 0.0022 0.0066 0.002
Plasmodium vivax SET domain protein, putative 0.0031 0.0199 0.0354
Echinococcus multilocularis dual 3',5' cyclic AMP and GMP phosphodiesterase 0.0282 0.3871 0.3842
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0026 0.0126 0.008
Loa Loa (eye worm) hypothetical protein 0.0329 0.4544 0.4543
Loa Loa (eye worm) hypothetical protein 0.0244 0.3304 0.3302
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0176 0.2325 0.5158
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0026 0.0126 0.008
Loa Loa (eye worm) hypothetical protein 0.0301 0.4143 0.4141
Loa Loa (eye worm) hypothetical protein 0.0176 0.2313 0.2311
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0282 0.3871 0.869
Loa Loa (eye worm) hypothetical protein 0.026 0.355 0.3549
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0282 0.3871 0.869
Echinococcus granulosus aryl hydrocarbon receptor 0.0035 0.0257 0.0211
Trypanosoma brucei 3', 5'-cyclic nucleotide phosphodiesterase, putative 0.0137 0.1751 0.3551
Onchocerca volvulus AMP deaminase 2 homolog 0.0085 0.0988 0.2687
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0282 0.3871 0.869
Loa Loa (eye worm) hypothetical protein 0.002 0.0047 0.0044
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0026 0.0126 0.0124
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0282 0.3871 0.869
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0026 0.0126 0.008
Trichomonas vaginalis calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0137 0.1751 0.3848
Onchocerca volvulus Bile acid receptor homolog 0.0026 0.0126 0.0227
Mycobacterium ulcerans two component sensor histidine kinase DevS 0.0114 0.1419 0.3913
Trypanosoma cruzi hypothetical protein, conserved 0.0137 0.1751 0.3656
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.0472 0.6631 0.6615
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0315 0.4344 0.6444
Echinococcus multilocularis geminin 0.0172 0.226 0.2224
Loa Loa (eye worm) hypothetical protein 0.0176 0.2313 0.2311
Onchocerca volvulus 0.0031 0.0199 0.0435
Plasmodium vivax 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0315 0.4344 1
Schistosoma mansoni coup transcription factor 0.0026 0.0126 0.0126
Mycobacterium ulcerans endonuclease IV 0.0078 0.0886 0.2389
Trypanosoma cruzi hypothetical protein, conserved 0.0137 0.1751 0.3656
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0137 0.1751 0.2413
Trichomonas vaginalis cGMP-inhibited 3,5-cyclic phosphodiesterase, putative 0.0137 0.1751 0.3848
Trypanosoma cruzi hypothetical protein, conserved 0.0137 0.1751 0.3656
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0282 0.3871 0.869
Echinococcus multilocularis calcium:calmodulin dependent 3',5' cyclic 0.0703 1 1
Loa Loa (eye worm) RecQ helicase 0.0022 0.0066 0.0064
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0249 0.3383 0.4949
Loa Loa (eye worm) AMP deaminase 0.0085 0.0988 0.0986
Trichomonas vaginalis conserved hypothetical protein 0.0145 0.187 0.412
Trypanosoma cruzi AMP deaminase, putative 0.0085 0.0988 0.1789
Mycobacterium leprae PROBABLE ENDONUCLEASE IV END (ENDODEOXYRIBONUCLEASE IV) (APURINASE) 0.0078 0.0886 0.2389
Plasmodium falciparum phosphodiesterase delta, putative 0.0137 0.1751 0.4892
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0137 0.1751 0.2413
Brugia malayi Probable 3',5'-cyclic phosphodiesterase R153.1, putative 0.0334 0.463 0.4605
Mycobacterium ulcerans putative regulatory protein 0.0037 0.0292 0.0693
Echinococcus multilocularis survival motor neuron protein 1 0.0244 0.3304 0.3272
Onchocerca volvulus Adenosine deaminase homolog 0.026 0.355 1
Echinococcus granulosus calcium:calmodulin dependent 3'5' cyclic 0.0703 1 1
Loa Loa (eye worm) hypothetical protein 0.0026 0.0126 0.0124
Schistosoma mansoni camp-specific cyclic nucleotide phosphodiesterase 0.0329 0.4544 0.4544
Trypanosoma brucei AMP deaminase, putative 0.0085 0.0988 0.1653
Loa Loa (eye worm) hypothetical protein 0.0026 0.0126 0.0124
Loa Loa (eye worm) hypothetical protein 0.0472 0.6631 0.663
Onchocerca volvulus 0.0085 0.0988 0.2687
Trypanosoma brucei AMP deaminase, putative 0.0085 0.0988 0.1653
Schistosoma mansoni AMP deaminase 0.0085 0.0988 0.0988
Plasmodium falciparum cGMP-specific phosphodiesterase 0.0137 0.1751 0.4892
Brugia malayi Nuclear hormone receptor-like 1 0.0026 0.0126 0.008
Echinococcus multilocularis FTZ F1 alpha 0.0026 0.0126 0.008
Loa Loa (eye worm) hypothetical protein 0.0219 0.2941 0.2939
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.0199 0.0199
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0282 0.3871 0.869
Schistosoma mansoni hypothetical protein 0.0172 0.226 0.226
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0282 0.3871 0.869
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0026 0.0126 0.008
Echinococcus multilocularis adenosine deaminase 0.026 0.355 0.352
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0026 0.0126 0.008
Leishmania major hypothetical protein, conserved 0.0039 0.0324 0.0163
Brugia malayi Probable 3',5'-cyclic phosphodiesterase C32E12.2, putative 0.0431 0.6037 0.6019
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.0472 0.6631 0.6615
Loa Loa (eye worm) hypothetical protein 0.0191 0.2543 0.2542
Loa Loa (eye worm) PDE1B protein 0.0703 1 1
Plasmodium falciparum AMP deaminase, putative 0.0085 0.0988 0.2726
Schistosoma mansoni adenosine deaminase-related 0.026 0.355 0.355
Loa Loa (eye worm) hypothetical protein 0.0176 0.2313 0.2311
Loa Loa (eye worm) hypothetical protein 0.002 0.0047 0.0044
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0137 0.1751 0.1751
Echinococcus multilocularis bloom syndrome protein 0.0022 0.0066 0.002
Schistosoma mansoni high-affinity cgmp-specific 35-cyclic phosphodiesterase 0.0249 0.3383 0.3383
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0061 0.0634 0.059
Brugia malayi Hypothetical 29.7 kDa protein C05D11.5 in chromosome III 0.002 0.0049 0.0002
Trichomonas vaginalis adenylate cyclase, type VII, putative 0.0035 0.0257 0.0435
Trypanosoma brucei adenosine monophosphate deaminase, putative 0.0085 0.0988 0.1653
Trypanosoma cruzi cAMP phosphodiesterase A, putative 0.0315 0.4344 1
Mycobacterium ulcerans adenosine deaminase 0.026 0.355 1
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0137 0.1751 0.3848
Loa Loa (eye worm) hypothetical protein 0.0026 0.0126 0.0124
Mycobacterium leprae conserved hypothetical protein 0.0075 0.0846 0.2276
Loa Loa (eye worm) hypothetical protein 0.002 0.0049 0.0046
Trypanosoma cruzi GAF domain/TIP41-like family, putative 0.0039 0.0324 0.0163
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0137 0.1751 0.2413
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0026 0.0126 0.008
Trypanosoma brucei hypothetical protein, conserved 0.0137 0.1751 0.3551
Loa Loa (eye worm) aryl Hydrocarbon receptor Associated protein family member 0.0035 0.0257 0.0255
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0282 0.3871 0.869
Entamoeba histolytica adenosine deaminase, putative 0.026 0.355 1
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0026 0.0126 0.008
Plasmodium vivax apurinic/apyrimidinic endonuclease Apn1, putative 0.0078 0.0886 0.1952
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0026 0.0126 0.008
Echinococcus granulosus ecdysone induced protein 78C 0.0026 0.0126 0.008
Brugia malayi DNA-(Apurinic or apyrimidinic site) lyase 0.0078 0.0886 0.0843
Trypanosoma cruzi AMP deaminase, putative 0.0085 0.0988 0.1789
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0137 0.1751 0.1751
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0207 0.2775 0.6162
Plasmodium vivax cyclic nucleotide phosphodiesterase, putative 0.0137 0.1751 0.3967
Brugia malayi 3'5'-cyclic nucleotide phosphodiesterase family protein 0.0564 0.7973 0.7964
Echinococcus multilocularis cAMP and cAMP inhibited cGMP 3',5' cyclic 0.0431 0.6037 0.6019
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0026 0.0126 0.008
Schistosoma mansoni rab6-interacting 0.002 0.0047 0.0047
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative 0.0282 0.3871 0.869
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0137 0.1751 0.2413
Trypanosoma cruzi AMP deaminase 2, putative 0.0085 0.0988 0.1789
Leishmania major AMP deaminase, putative,amp deaminase-like protein 0.0085 0.0988 0.1789
Loa Loa (eye worm) hypothetical protein 0.0085 0.0988 0.0986
Echinococcus granulosus lysine specific demethylase 5A 0.0061 0.0634 0.059
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0026 0.0126 0.0126
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0026 0.0126 0.0126
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.0472 0.6631 0.6615
Trypanosoma cruzi hypothetical protein, conserved 0.0137 0.1751 0.3656
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0137 0.1751 0.3848
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0176 0.2325 0.5158
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0212 0.2847 0.6351
Trichomonas vaginalis cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative 0.0207 0.2775 0.6188
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0026 0.0126 0.0124
Brugia malayi Pre-SET motif family protein 0.0214 0.2878 0.2844
Loa Loa (eye worm) doublecortin family protein 0.002 0.0047 0.0044
Plasmodium falciparum GAF domain-related protein, putative 0.0075 0.0846 0.2322
Schistosoma mansoni lipoxygenase 0.002 0.0047 0.0047
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0026 0.0126 0.008
Brugia malayi photoreceptor-specific nuclear receptor 0.0026 0.0126 0.008
Echinococcus granulosus high affinity cAMP specific 3'5' cyclic 0.0137 0.1751 0.1712
Trichomonas vaginalis guanylate cyclase, putative 0.0035 0.0257 0.0435
Trypanosoma brucei 3', 5'-cyclic nucleotide phosphodiesterase, putative 0.0137 0.1751 0.3551
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0282 0.3871 0.869
Onchocerca volvulus 0.0244 0.331 0.9314
Trypanosoma brucei cAMP-specific phosphodiesterase 0.0282 0.3871 0.8824
Toxoplasma gondii hypothetical protein 0.0075 0.0846 0.1006
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0472 0.6631 1
Schistosoma mansoni adenosine deaminase 0.026 0.355 0.355
Schistosoma mansoni polycystin 1-related 0.002 0.0047 0.0047
Trypanosoma cruzi AMP deaminase, putative 0.0085 0.0988 0.1789
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0026 0.0126 0.0126
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0322 0.4444 1
Leishmania major cAMP phosphodiesterase A, putative;with=GeneDB:LinJ18_V3.1100 0.0315 0.4344 1
Echinococcus granulosus cAMP and cAMP inhibited cGMP 3'5' cyclic 0.0431 0.6037 0.6019
Schistosoma mansoni jumonji domain containing protein 0.0061 0.0634 0.0634
Echinococcus granulosus histone lysine methyltransferase setb 0.0031 0.0199 0.0153
Loa Loa (eye worm) hypothetical protein 0.0026 0.0126 0.0124
Trichomonas vaginalis guanylate cyclase, putative 0.0035 0.0257 0.0435
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0137 0.1751 0.2413
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0282 0.3871 0.869
Schistosoma mansoni high-affinity cgmp-specific 35-cyclic phosphodiesterase 0.0137 0.1751 0.1751
Trichomonas vaginalis adenosine deaminase, putative 0.026 0.355 0.7958
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0026 0.0126 0.0124
Onchocerca volvulus 0.0026 0.0126 0.0227
Trichomonas vaginalis conserved hypothetical protein 0.0035 0.0257 0.0435
Trichomonas vaginalis conserved hypothetical protein 0.0075 0.0846 0.178
Trypanosoma cruzi adenosine monophosphate deaminase, putative 0.0085 0.0988 0.1789
Echinococcus multilocularis thyroid hormone receptor alpha 0.0026 0.0126 0.008
Echinococcus granulosus calcium:calmodulin dependent 3'5' cyclic 0.0315 0.4344 0.4317
Brugia malayi hypothetical protein 0.019 0.252 0.2484
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0035 0.0257 0.0435
Loa Loa (eye worm) hypothetical protein 0.0294 0.4037 0.4035
Plasmodium falciparum 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0137 0.1751 0.4892
Echinococcus granulosus adenosine deaminase 0.026 0.355 0.352
Brugia malayi Steroid receptor seven-up type 2 0.0026 0.0126 0.008
Trypanosoma cruzi cAMP-specific phosphodiesterase, putative 0.0137 0.1751 0.3656
Schistosoma mansoni aryl hydrocarbon receptor 0.0072 0.0798 0.0798
Trypanosoma cruzi GAF domain/TIP41-like family, putative 0.0039 0.0324 0.0163
Trichomonas vaginalis adenylate cyclase, putative 0.0035 0.0257 0.0435
Echinococcus multilocularis lysine specific demethylase 5A 0.0061 0.0634 0.059
Schistosoma mansoni hypothetical protein 0.005 0.0475 0.0475
Schistosoma mansoni thyroid hormone receptor 0.0026 0.0126 0.0126
Echinococcus multilocularis AMP deaminase 2 0.0085 0.0988 0.0946
Plasmodium falciparum phosphodiesterase gamma, putative 0.0137 0.1751 0.4892
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0061 0.0634 0.059
Loa Loa (eye worm) hypothetical protein 0.0564 0.7973 0.7973
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0472 0.6631 0.6631
Schistosoma mansoni steroid hormone receptor ad4bp 0.0026 0.0126 0.0126
Onchocerca volvulus 0.0037 0.0292 0.0699
Brugia malayi adenosine monophosphate deaminase 0.0085 0.0988 0.0946
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0026 0.0126 0.008
Trichomonas vaginalis conserved hypothetical protein 0.0137 0.1751 0.3848
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0282 0.3871 0.869
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.005 0.0475 0.0431
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0212 0.2847 0.6351
Schistosoma mansoni rab6-interacting 0.002 0.0047 0.0047
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0282 0.3871 0.869
Plasmodium falciparum 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0249 0.3383 0.9524
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0137 0.1751 0.2413
Loa Loa (eye worm) hypothetical protein 0.0035 0.0257 0.0255
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0137 0.1751 0.2413
Onchocerca volvulus 0.005 0.0475 0.1223
Echinococcus granulosus high affinity cgmp specific 3' 5' cyclic 0.0249 0.3383 0.3351
Leishmania major hypothetical protein, conserved 0.0137 0.1751 0.3656
Trypanosoma brucei cAMP-specific phosphodiesterase 0.0282 0.3871 0.8824
Mycobacterium tuberculosis Conserved hypothetical protein 0.0039 0.0324 0.0785
Entamoeba histolytica adenosine deaminase, putative 0.026 0.355 1
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0322 0.4444 1
Leishmania major adenine aminohydrolase 0.026 0.355 0.8059
Trichomonas vaginalis soluble guanylate cyclase gcy, putative 0.0035 0.0257 0.0435
Loa Loa (eye worm) hypoxia-induced factor 1 0.0155 0.2013 0.2011
Brugia malayi steroid hormone receptor 0.0026 0.0126 0.008
Trypanosoma cruzi adenosine monophosphate deaminase-like protein, putative 0.0085 0.0988 0.1789
Loa Loa (eye worm) hypothetical protein 0.0026 0.0126 0.0124
Toxoplasma gondii hypothetical protein 0.0075 0.0846 0.1006
Onchocerca volvulus 0.0035 0.0257 0.06
Trichomonas vaginalis cAMP/cGMP cyclic nucleotide phosphodiesterase, putative 0.0282 0.3871 0.869
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0026 0.0126 0.008
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.003 0.0183 0.0136
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0282 0.3871 0.869
Chlamydia trachomatis endonuclease IV 0.0078 0.0886 1
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0035 0.0257 0.0435
Trichomonas vaginalis conserved hypothetical protein 0.0137 0.1751 0.3848
Echinococcus multilocularis high affinity cgmp specific 3' 5' cyclic 0.0249 0.3383 0.3351
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0026 0.0126 0.0126
Brugia malayi 3'5'-cyclic nucleotide phosphodiesterase family protein 0.0329 0.4544 0.4519
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0137 0.1751 0.2413
Trypanosoma cruzi cAMP phosphodiesterase A, putative 0.0315 0.4344 1
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0282 0.3871 0.869
Schistosoma mansoni high-affinity cgmp-specific 35-cyclic phosphodiesterase 0.0137 0.1751 0.1751
Echinococcus granulosus dual 3'5' cyclic AMP and GMP phosphodiesterase 0.0282 0.3871 0.3842
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0026 0.0126 0.0126
Schistosoma mansoni thyroid hormone receptor 0.0026 0.0126 0.0126
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0137 0.1751 0.3848
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0026 0.0126 0.008
Schistosoma mansoni retinoic acid receptor RXR 0.0026 0.0126 0.0126
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.0472 0.6631 0.6615
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0137 0.1751 0.2413
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0282 0.3871 0.869
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0137 0.1751 0.2413
Plasmodium vivax hypothetical protein, conserved 0.0075 0.0846 0.186
Trypanosoma brucei cAMP-specific phosphodiesterase, putative 0.0137 0.1751 0.3551
Loa Loa (eye worm) cyclic AMP specific phosphodiesterase PDE4D5A 0.0334 0.463 0.4629
Echinococcus granulosus survival motor neuron protein 1 0.0244 0.3304 0.3272
Echinococcus multilocularis ecdysone induced protein 78C 0.0026 0.0126 0.008
Echinococcus granulosus Aryl hydrocarbon receptor nuclear 0.0035 0.0257 0.0211
Trichomonas vaginalis cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative 0.0137 0.1751 0.3848
Mycobacterium tuberculosis Probable adenosine deaminase Add (adenosine aminohydrolase) 0.026 0.355 1
Mycobacterium tuberculosis Two component sensor histidine kinase DevS 0.0114 0.1419 0.3913
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0282 0.3871 0.869
Brugia malayi jmjC domain containing protein 0.0061 0.0634 0.059
Trichomonas vaginalis conserved hypothetical protein 0.0322 0.4444 1
Echinococcus granulosus FTZ F1 alpha 0.0026 0.0126 0.008
Echinococcus multilocularis aryl hydrocarbon receptor 0.0035 0.0257 0.0211
Schistosoma mansoni hypothetical protein 0.002 0.0047 0.0047
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0137 0.1751 0.2413
Plasmodium falciparum cGMP-specific phosphodiesterase 0.0137 0.1751 0.4892
Schistosoma mansoni cgmp-dependent 35-cyclic phosphodiesterase 0.0301 0.4143 0.4143
Brugia malayi nuclear hormone receptor 0.0026 0.0126 0.008
Brugia malayi hypothetical protein 0.0244 0.3304 0.3272
Trypanosoma brucei AMP deaminase, putative 0.0085 0.0988 0.1653
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0026 0.0126 0.008
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0026 0.0126 0.0124
Toxoplasma gondii endonuclease IV APN 0.0078 0.0886 0.1067
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0282 0.3871 0.869
Plasmodium vivax phosphodiesterase gamma, putative 0.0137 0.1751 0.3967
Leishmania major AMP deaminase, putative 0.0085 0.0988 0.1789
Schistosoma mansoni RAR-like nuclear receptor 0.0026 0.0126 0.0126
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.0334 0.463 0.4605
Onchocerca volvulus Protein ultraspiracle homolog 0.0026 0.0126 0.0227
Leishmania major adenosine monophosphate deaminase, putative,AMP deaminase, putative 0.0085 0.0988 0.1789
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0026 0.0126 0.008
Leishmania major AMP deaminase, putative,adenosine monophosphate deaminase-like protein 0.0085 0.0988 0.1789
Echinococcus granulosus geminin 0.0172 0.226 0.2224
Schistosoma mansoni single-minded 0.0072 0.0798 0.0798
Trypanosoma cruzi hypothetical protein, conserved 0.0137 0.1751 0.3656
Brugia malayi Pre-SET motif family protein 0.0031 0.0199 0.0153
Mycobacterium tuberculosis Probable endonuclease IV End (endodeoxyribonuclease IV) (apurinase) 0.0078 0.0886 0.2389
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0137 0.1751 0.2413
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0026 0.0126 0.008
Plasmodium falciparum adenosine deaminase 0.026 0.355 1
Trypanosoma cruzi hypothetical protein, conserved 0.0137 0.1751 0.3656
Echinococcus multilocularis calcium:calmodulin dependent 3',5' cyclic 0.0315 0.4344 0.4317
Echinococcus multilocularis Aryl hydrocarbon receptor nuclear 0.0035 0.0257 0.0211
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0035 0.0257 0.0435
Trichomonas vaginalis cGMP-inhibited 3,5-cyclic phosphodiesterase, putative 0.0282 0.3871 0.869
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0026 0.0126 0.008
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0026 0.0126 0.008
Loa Loa (eye worm) hypothetical protein 0.0078 0.0886 0.0883
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0031 0.0199 0.0153
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0026 0.0126 0.008
Toxoplasma gondii hypothetical protein 0.0145 0.187 0.2598
Schistosoma mansoni calcium/calmodulin-dependent 35-cyclic nucleotide phosphodiesterase 0.0703 1 1
Echinococcus granulosus single minded 2 0.0037 0.0292 0.0246
Schistosoma mansoni lipoxygenase 0.0057 0.058 0.058
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0026 0.0126 0.008
Mycobacterium ulcerans putative regulatory protein 0.0075 0.0846 0.2276
Loa Loa (eye worm) hypothetical protein 0.0191 0.2543 0.2542
Mycobacterium ulcerans putative regulatory protein 0.0075 0.0846 0.2276
Schistosoma mansoni loxhd1 0.002 0.0047 0.0047
Brugia malayi nuclear receptor NHR-88 0.0026 0.0126 0.008
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0031 0.0199 0.0199
Plasmodium vivax 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0137 0.1751 0.3967
Loa Loa (eye worm) hypothetical protein 0.0026 0.0126 0.0124
Treponema pallidum adenosine deaminase 0.026 0.355 0.5
Leishmania major cAMP-specific phosphodiesterase, putative 0.0137 0.1751 0.3656
Trichomonas vaginalis conserved hypothetical protein 0.0145 0.187 0.412
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0026 0.0126 0.008
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0282 0.3871 0.869
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0031 0.0199 0.0153
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0315 0.4344 0.6444
Loa Loa (eye worm) hypothetical protein 0.0031 0.0199 0.0197
Loa Loa (eye worm) hypothetical protein 0.0026 0.0126 0.0124
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0207 0.2775 0.6188
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0026 0.0126 0.008
Loa Loa (eye worm) hypothetical protein 0.019 0.252 0.2518
Plasmodium falciparum apurinic/apyrimidinic endonuclease Apn1, putative 0.0078 0.0886 0.2434
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0282 0.3871 0.8843
Giardia lamblia CAMP-specific 3,5-cyclic phosphodiesterase 4B 0.0472 0.6631 1
Schistosoma mansoni nuclear hormone receptor 0.0026 0.0126 0.0126
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0057 0.058 0.0536
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0026 0.0126 0.008
Mycobacterium tuberculosis Two component sensor histidine kinase DosT 0.0075 0.0846 0.2276
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.0199 0.0199
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0026 0.0126 0.008
Toxoplasma gondii GAF domain-containing protein 0.0075 0.0846 0.1006
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.0199 0.0199
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0026 0.0126 0.008
Schistosoma mansoni jumonji/arid domain-containing protein 0.0061 0.0634 0.0634
Echinococcus multilocularis transfer RNA-Lys 0.0037 0.0292 0.0246
Schistosoma mansoni camp/cgmp cyclic nucleotide phosphodiesterase 0.0282 0.3871 0.3871
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0282 0.3871 0.869
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0282 0.3871 0.869
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0026 0.0126 0.0124
Brugia malayi Adenosine/AMP deaminase family protein 0.026 0.355 0.352
Loa Loa (eye worm) steroid hormone receptor 0.0026 0.0126 0.0124
Trypanosoma brucei cAMP phosphodiesterase A, putative 0.0315 0.4344 1
Plasmodium vivax adenosine deaminase, putative 0.026 0.355 0.8154
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0026 0.0126 0.0126
Toxoplasma gondii Adenosine/AMP deaminase domain-containing protein 0.026 0.355 0.521
Brugia malayi bHLH-PAS transcription factor 0.0037 0.0292 0.0246
Echinococcus granulosus AMP deaminase 2 0.0085 0.0988 0.0946
Trichomonas vaginalis conserved hypothetical protein 0.0035 0.0257 0.0435
Trichomonas vaginalis conserved hypothetical protein 0.0145 0.187 0.412
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0026 0.0126 0.0124
Onchocerca volvulus Putative hydroxypyruvate isomerase 0.002 0.0049 0.0006
Loa Loa (eye worm) hypothetical protein 0.0426 0.5972 0.5971
Brugia malayi Probable 3',5'-cyclic phosphodiesterase R153.1, putative 0.0137 0.1751 0.1712
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0282 0.3871 0.8843

Activities

Activity type Activity value Assay description Source Reference
Ki (binding) > 2000 uM Inhibition of Calpain ChEMBL. 2296008

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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