Detailed information for compound 325946

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 375.464 | Formula: C23H25N3O2
  • H donors: 1 H acceptors: 2 LogP: 2.86 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCNC(=O)c1ccc(cc1)/C(=C/1\C[C@@H]2CC[C@H](C1)N2Cc1cocc1)/C#N
  • InChi: 1S/C23H25N3O2/c1-2-25-23(27)18-5-3-17(4-6-18)22(13-24)19-11-20-7-8-21(12-19)26(20)14-16-9-10-28-15-16/h3-6,9-10,15,20-21H,2,7-8,11-12,14H2,1H3,(H,25,27)/b22-19-/t20-,21+/m1/s1
  • InChiKey: BKCDCSOAOQZEDS-YJKMOJFLSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Mus musculus opioid receptor, mu 1 Starlite/ChEMBL References

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
Brugia malayi ImpB/MucB/SamB family protein 0.005 0.0011 0.0028
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0861 0.0663 0.5419
Trypanosoma brucei cAMP phosphodiesterase A, putative 0.024 0.0163 0.2464
Echinococcus granulosus geminin 0.0187 0.0121 0.0321
Plasmodium falciparum phosphodiesterase gamma, putative 0.024 0.0163 0.2689
Trichomonas vaginalis CAMK family protein kinase 0.0105 0.0055 0.0451
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.024 0.0163 0.2464
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.024 0.0163 0.0432
Trichomonas vaginalis CAMK family protein kinase 0.0105 0.0055 0.0451
Schistosoma mansoni camp/cgmp cyclic nucleotide phosphodiesterase 0.0861 0.0663 0.3435
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.1557 0.1223 1
Plasmodium falciparum 3',5'-cyclic nucleotide phosphodiesterase, putative 0.024 0.0163 0.2689
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0227 0.0153 0.0115
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0252 0.0173 0.0138
Mycobacterium tuberculosis Two component sensor histidine kinase DevS 0.1317 0.103 0.11
Onchocerca volvulus 0.0363 0.0262 0.2165
Mycobacterium leprae PROBABLE METHYLTRANSFERASE 0.1294 0.1012 1
Echinococcus granulosus calcium:calmodulin dependent 3'5' cyclic 0.024 0.0163 0.0432
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0936 0.0723 0.5916
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0861 0.0663 0.5419
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.024 0.0163 0.3474
Loa Loa (eye worm) hypothetical protein 0.024 0.0163 0.0455
Trichomonas vaginalis conserved hypothetical protein 0.1557 0.1223 1
Schistosoma mansoni high-affinity cgmp-specific 35-cyclic phosphodiesterase 0.024 0.0163 0.0846
Trypanosoma cruzi hypothetical protein, conserved 0.024 0.0163 0.2464
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0091 0.0044 0.0226
Echinococcus granulosus high affinity cAMP specific 3'5' cyclic 0.024 0.0163 0.0432
Trypanosoma cruzi hypothetical protein, conserved 0.024 0.0163 0.2464
Brugia malayi Probable 3',5'-cyclic phosphodiesterase T04D3.3, putative 0.024 0.0163 0.0432
Echinococcus granulosus dna polymerase eta 0.005 0.0011 0.0028
Trichomonas vaginalis conserved hypothetical protein 0.024 0.0163 0.1335
Trichomonas vaginalis conserved hypothetical protein 0.024 0.0163 0.1335
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0861 0.0663 0.5419
Trypanosoma cruzi ATP-dependent 6-phosphofructokinase, glycosomal 0.012 0.0067 0.1014
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.024 0.0163 0.3474
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.1557 0.1223 1
Echinococcus multilocularis calcium:calmodulin dependent 3',5' cyclic 0.024 0.0163 0.0432
Trichomonas vaginalis CAMK family protein kinase 0.0105 0.0055 0.0451
Trypanosoma cruzi hypothetical protein, conserved 0.024 0.0163 0.2464
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.024 0.0163 0.3474
Brugia malayi 3'5'-cyclic nucleotide phosphodiesterase family protein 0.024 0.0163 0.0432
Trypanosoma cruzi cyclic nucleotide phosphodiesterase 0.024 0.0163 0.2464
Mycobacterium tuberculosis Conserved hypothetical protein 0.0696 0.0531 0.0539
Leishmania major hypothetical protein, conserved 0.024 0.0163 0.2464
Schistosoma mansoni hypothetical protein 0.0187 0.0121 0.0629
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0861 0.0663 0.5419
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0227 0.0153 0.0115
Plasmodium vivax cyclic nucleotide phosphodiesterase, putative 0.024 0.0163 0.2689
Schistosoma mansoni tar DNA-binding protein 0.0133 0.0078 0.0403
Trichomonas vaginalis conserved hypothetical protein 0.0621 0.047 0.3843
Echinococcus granulosus tar DNA binding protein 0.0133 0.0078 0.0206
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.024 0.0163 0.3474
Mycobacterium tuberculosis Probable oxidoreductase 0.0252 0.0173 0.0138
Loa Loa (eye worm) glutathione reductase 0.0099 0.005 0.0141
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0252 0.0173 0.0138
Loa Loa (eye worm) phosphofructokinase 0.012 0.0067 0.0187
Onchocerca volvulus 0.1294 0.1012 1
Trypanosoma cruzi cAMP phosphodiesterase A, putative 0.024 0.0163 0.2464
Echinococcus multilocularis geminin 0.0187 0.0121 0.0321
Echinococcus granulosus calcium:calmodulin dependent 3'5' cyclic 0.024 0.0163 0.0432
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0861 0.0663 0.5419
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.024 0.0163 0.0432
Trypanosoma cruzi GAF domain/TIP41-like family, putative 0.0696 0.0531 0.8008
Plasmodium vivax phosphodiesterase gamma, putative 0.024 0.0163 0.2689
Schistosoma mansoni serine/threonine protein kinase 0.0105 0.0055 0.0286
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative 0.0861 0.0663 0.5419
Mycobacterium tuberculosis Two component sensor histidine kinase DosT 0.0621 0.047 0.0471
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0105 0.0055 0.0154
Giardia lamblia CAMP-specific 3,5-cyclic phosphodiesterase 4B 0.024 0.0163 1
Schistosoma mansoni tar DNA-binding protein 0.0133 0.0078 0.0403
Loa Loa (eye worm) hypothetical protein 0.024 0.0163 0.0455
Echinococcus granulosus thioredoxin glutathione reductase 0.0099 0.005 0.0134
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.024 0.0163 0.3474
Trypanosoma brucei 3', 5'-cyclic nucleotide phosphodiesterase, putative 0.024 0.0163 0.2464
Trichomonas vaginalis conserved hypothetical protein 0.0621 0.047 0.3843
Plasmodium falciparum cGMP-specific phosphodiesterase 0.024 0.0163 0.2689
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0861 0.0663 0.5419
Trichomonas vaginalis conserved hypothetical protein 0.0621 0.047 0.3843
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.024 0.0163 0.0846
Loa Loa (eye worm) 6-phosphofructokinase 0.012 0.0067 0.0187
Plasmodium falciparum 3',5'-cyclic nucleotide phosphodiesterase, putative 0.024 0.0163 0.2689
Trichomonas vaginalis cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative 0.024 0.0163 0.1335
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0091 0.0044 0.0115
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0227 0.0153 0.0907
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.012 0.0067 0.5
Echinococcus multilocularis calcium:calmodulin dependent 3',5' cyclic 0.024 0.0163 0.0432
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.024 0.0163 0.1335
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.024 0.0163 0.3474
Trichomonas vaginalis cAMP/cGMP cyclic nucleotide phosphodiesterase, putative 0.0861 0.0663 0.5419
Toxoplasma gondii hypothetical protein 0.0621 0.047 1
Echinococcus multilocularis 6 phosphofructokinase 0.012 0.0067 0.0178
Trichomonas vaginalis phosphofructokinase, putative 0.012 0.0067 0.055
Loa Loa (eye worm) RNA binding protein 0.0133 0.0078 0.0217
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0861 0.0663 0.5419
Schistosoma mansoni high-affinity cgmp-specific 35-cyclic phosphodiesterase 0.024 0.0163 0.0846
Schistosoma mansoni kinase 0.0053 0.0014 0.007
Trichomonas vaginalis CAMK family protein kinase 0.0052 0.0012 0.0101
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.024 0.0163 0.3474
Loa Loa (eye worm) calcium/calmodulin-stimulated cyclic nucleotide phosphodiesterase 0.024 0.0163 0.0455
Loa Loa (eye worm) hypothetical protein 0.024 0.0163 0.0455
Schistosoma mansoni o-methyltransferase 0.1294 0.1012 0.5244
Brugia malayi RNA recognition motif domain containing protein 0.0133 0.0078 0.0206
Brugia malayi Thioredoxin reductase 0.0099 0.005 0.0134
Trypanosoma cruzi hypothetical protein, conserved 0.024 0.0163 0.2464
Mycobacterium tuberculosis Probable catechol-O-methyltransferase 1.1177 0.8959 1
Trichomonas vaginalis CAMK family protein kinase 0.0105 0.0055 0.0451
Loa Loa (eye worm) O-methyltransferase 0.1294 0.1012 0.282
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0861 0.0663 1
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0861 0.0663 0.5419
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0091 0.0044 0.0226
Brugia malayi 6-phosphofructokinase 0.012 0.0067 0.0178
Onchocerca volvulus 0.1294 0.1012 1
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.1557 0.1223 1
Entamoeba histolytica phosphofructokinase, putative 0.012 0.0067 1
Leishmania major cAMP phosphodiesterase A, putative;with=GeneDB:LinJ18_V3.1100 0.024 0.0163 0.2464
Schistosoma mansoni hypothetical protein 0.0187 0.0121 0.0629
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0861 0.0663 0.5419
Echinococcus multilocularis high affinity cgmp specific 3' 5' cyclic 0.024 0.0163 0.0432
Leishmania major trypanothione reductase 0.0099 0.005 0.0762
Brugia malayi O-methyltransferase family protein 0.1294 0.1012 0.2676
Trypanosoma cruzi hypothetical protein, conserved 0.024 0.0163 0.2464
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0227 0.0153 0.0115
Loa Loa (eye worm) TAR-binding protein 0.0133 0.0078 0.0217
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0091 0.0044 0.0115
Onchocerca volvulus 0.0363 0.0262 0.2165
Leishmania major cAMP-specific phosphodiesterase, putative 0.024 0.0163 0.2464
Schistosoma mansoni o-methyltransferase 0.1294 0.1012 0.5244
Echinococcus multilocularis tar DNA binding protein 0.0133 0.0078 0.0206
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0861 0.0663 0.5419
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.024 0.0163 0.3474
Brugia malayi 3'5'-cyclic nucleotide phosphodiesterase family protein 0.024 0.0163 0.0432
Loa Loa (eye worm) hypothetical protein 0.005 0.0011 0.003
Schistosoma mansoni tar DNA-binding protein 0.0133 0.0078 0.0403
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0091 0.0044 0.0115
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0091 0.0044 0.0115
Trichomonas vaginalis cGMP-inhibited 3,5-cyclic phosphodiesterase, putative 0.024 0.0163 0.1335
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.024 0.0163 0.0432
Schistosoma mansoni high-affinity cgmp-specific 35-cyclic phosphodiesterase 0.024 0.0163 0.0846
Trypanosoma brucei DNA polymerase eta, putative 0.005 0.0011 0.016
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.024 0.0163 0.3474
Trypanosoma cruzi phospholipase A2-like protein, putative 0.0166 0.0104 0.1574
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0105 0.0055 0.0146
Loa Loa (eye worm) platelet-activating factor acetylhydrolase 0.0363 0.0262 0.0731
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.024 0.0163 0.0846
Mycobacterium ulcerans putative regulatory protein 0.0621 0.047 0.047
Echinococcus multilocularis dual 3',5' cyclic AMP and GMP phosphodiesterase 0.0861 0.0663 0.1753
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0252 0.0173 0.1122
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0861 0.0663 0.5419
Trypanosoma cruzi cAMP-specific phosphodiesterase, putative 0.024 0.0163 0.2464
Plasmodium vivax 3',5'-cyclic nucleotide phosphodiesterase, putative 0.024 0.0163 0.2689
Leishmania major hypothetical protein, conserved 0.0696 0.0531 0.8008
Brugia malayi 6-phosphofructokinase 0.012 0.0067 0.0178
Trypanosoma cruzi polo-like protein kinase, putative 0.0105 0.0055 0.0831
Trypanosoma brucei cAMP-specific phosphodiesterase, putative 0.024 0.0163 0.2464
Brugia malayi hypothetical protein 0.0168 0.0106 0.028
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.024 0.0163 0.3474
Trichomonas vaginalis phosphofructokinase, putative 0.012 0.0067 0.055
Mycobacterium leprae conserved hypothetical protein 0.0621 0.047 0.4265
Trypanosoma cruzi phospholipase A1, putative 0.0363 0.0262 0.3957
Toxoplasma gondii hypothetical protein 0.0621 0.047 1
Trichomonas vaginalis cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative 0.024 0.0163 0.1335
Loa Loa (eye worm) hypothetical protein 0.0168 0.0106 0.0295
Onchocerca volvulus 0.0363 0.0262 0.2165
Loa Loa (eye worm) 6-phosphofructokinase 0.012 0.0067 0.0187
Mycobacterium ulcerans putative regulatory protein 0.0621 0.047 0.047
Brugia malayi O-methyltransferase family protein 0.1294 0.1012 0.2676
Plasmodium falciparum GAF domain-related protein, putative 0.0621 0.047 1
Brugia malayi RNA binding protein 0.0133 0.0078 0.0206
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0861 0.0663 0.5419
Toxoplasma gondii hypothetical protein 0.0621 0.047 1
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.024 0.0163 0.3474
Schistosoma mansoni calcium/calmodulin-dependent 35-cyclic nucleotide phosphodiesterase 0.024 0.0163 0.0846
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.024 0.0163 0.1335
Giardia lamblia Hypothetical protein 0.024 0.0163 1
Mycobacterium tuberculosis Probable dehydrogenase 0.0227 0.0153 0.0115
Trypanosoma brucei phospholipase A1, putative 0.0363 0.0262 0.3957
Plasmodium vivax 3',5'-cyclic nucleotide phosphodiesterase, putative 0.024 0.0163 0.2689
Toxoplasma gondii GAF domain-containing protein 0.0621 0.047 1
Giardia lamblia hypothetical protein 0.024 0.0163 1
Trypanosoma cruzi DNA polymerase eta, putative 0.005 0.0011 0.016
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0861 0.0663 0.5419
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0105 0.0055 0.0831
Mycobacterium tuberculosis Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase) 0.012 0.0067 0.0019
Trypanosoma brucei GAF domain/TIP41-like family, putative 0.0696 0.0531 0.8008
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0861 0.0663 0.5419
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.024 0.0163 0.1335
Trypanosoma brucei trypanothione reductase 0.0099 0.005 0.0762
Echinococcus granulosus high affinity cgmp specific 3' 5' cyclic 0.024 0.0163 0.0432
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0936 0.0723 0.5916
Brugia malayi phosphofructokinase 0.012 0.0067 0.0178
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0861 0.0663 0.5419
Plasmodium falciparum phosphodiesterase delta, putative 0.024 0.0163 0.2689
Schistosoma mansoni tar DNA-binding protein 0.0133 0.0078 0.0403
Entamoeba histolytica phosphofructokinase, putative 0.012 0.0067 1
Trypanosoma cruzi phospholipase A2-like protein, putative 0.0166 0.0104 0.1574
Schistosoma mansoni cgmp-dependent 35-cyclic phosphodiesterase 0.2435 0.1929 1
Mycobacterium ulcerans methyltransferase 0.1294 0.1012 0.1012
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0227 0.0153 0.0115
Leishmania major hypothetical protein, conserved 0.024 0.0163 0.2464
Mycobacterium ulcerans two component sensor histidine kinase DevS 0.1317 0.103 0.103
Loa Loa (eye worm) PDE1B protein 0.024 0.0163 0.0455
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0091 0.0044 0.0115
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.024 0.0163 0.3474
Trypanosoma cruzi cAMP phosphodiesterase A, putative 0.024 0.0163 0.2464
Brugia malayi Probable 3',5'-cyclic phosphodiesterase R153.1, putative 0.024 0.0163 0.0432
Brugia malayi serine/threonine-protein kinase plk-2 0.0105 0.0055 0.0146
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.024 0.0163 0.1335
Trypanosoma cruzi GAF domain/TIP41-like family, putative 0.0696 0.0531 0.8008
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0861 0.0663 0.5419
Leishmania major phospholipase A1, putative 0.0363 0.0262 0.3957
Trypanosoma cruzi hypothetical protein, conserved 0.024 0.0163 0.2464
Brugia malayi Platelet-activating factor acetylhydrolase, plasma/intracellular isoform II family protein 0.0363 0.0262 0.0694
Schistosoma mansoni o-methyltransferase 0.1294 0.1012 0.5244
Schistosoma mansoni camp-specific cyclic nucleotide phosphodiesterase 0.024 0.0163 0.0846
Mycobacterium ulcerans 6-phosphofructokinase 0.012 0.0067 0.0067
Trichomonas vaginalis CAMK family protein kinase 0.0105 0.0055 0.0451
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0861 0.0663 0.5419
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0091 0.0044 0.0122
Echinococcus multilocularis high affinity cAMP specific 3',5' cyclic 0.024 0.0163 0.0432
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0105 0.0055 0.0146
Trypanosoma brucei ATP-dependent 6-phosphofructokinase, glycosomal 0.012 0.0067 0.1014
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0861 0.0663 0.5419
Echinococcus granulosus dual 3'5' cyclic AMP and GMP phosphodiesterase 0.0861 0.0663 0.1753
Trypanosoma brucei cAMP-specific phosphodiesterase 0.0861 0.0663 1
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.024 0.0163 0.1335
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.024 0.0163 0.0846
Trichomonas vaginalis phosphofructokinase, putative 0.012 0.0067 0.055
Echinococcus granulosus 6 phosphofructokinase 0.012 0.0067 0.0178
Loa Loa (eye worm) hypothetical protein 0.3876 0.3087 0.8608
Schistosoma mansoni DNA polymerase eta 0.005 0.0011 0.0055
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0861 0.0663 0.5419
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0133 0.0078 0.0217
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.024 0.0163 0.3474
Wolbachia endosymbiont of Brugia malayi O-methyltransferase 0.1294 0.1012 1
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0861 0.0663 0.5419
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0861 0.0663 1
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0861 0.0663 0.5419
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0091 0.0044 0.0226
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.024 0.0163 0.3474
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0861 0.0663 0.5419
Brugia malayi glutathione reductase 0.0099 0.005 0.0134
Brugia malayi TAR-binding protein 0.0133 0.0078 0.0206
Loa Loa (eye worm) hypothetical protein 0.1294 0.1012 0.282
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.024 0.0163 0.0846
Trypanosoma brucei cAMP-specific phosphodiesterase 0.0861 0.0663 1
Trichomonas vaginalis phosphofructokinase, putative 0.012 0.0067 0.055
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.024 0.0163 0.3474
Mycobacterium tuberculosis Probable methyltransferase 0.1294 0.1012 0.1079
Trichomonas vaginalis CAMK family protein kinase 0.0105 0.0055 0.0451
Plasmodium vivax hypothetical protein, conserved 0.0621 0.047 1
Trichomonas vaginalis CAMK family protein kinase 0.0105 0.0055 0.0451
Trypanosoma cruzi phospholipase A1, putative 0.0363 0.0262 0.3957
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.024 0.0163 0.3474
Leishmania major DNA polymerase eta, putative 0.005 0.0011 0.016
Schistosoma mansoni tar DNA-binding protein 0.0133 0.0078 0.0403
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.024 0.0163 0.0432
Trypanosoma brucei 3', 5'-cyclic nucleotide phosphodiesterase, putative 0.024 0.0163 0.2464
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.024 0.0163 0.1335
Trypanosoma cruzi trypanothione reductase, putative 0.0099 0.005 0.0762
Trichomonas vaginalis CAMK family protein kinase 0.0052 0.0012 0.0101
Echinococcus multilocularis thioredoxin glutathione reductase 0.0099 0.005 0.0134
Trypanosoma brucei hypothetical protein, conserved 0.024 0.0163 0.2464
Entamoeba histolytica serine/threonine protein kinase, putative 0.0105 0.0055 0.8195
Mycobacterium tuberculosis Probable reductase 0.0227 0.0153 0.0115
Leishmania major ATP-dependent phosphofructokinase 0.012 0.0067 0.1014
Schistosoma mansoni 6-phosphofructokinase 0.012 0.0067 0.0348
Brugia malayi O-methyltransferase family protein 0.1294 0.1012 0.2676
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.024 0.0163 0.3474
Entamoeba histolytica phosphofructokinase, putative 0.012 0.0067 1
Loa Loa (eye worm) hypothetical protein 0.2435 0.1929 0.5378
Trypanosoma cruzi polo-like protein kinase, putative 0.0105 0.0055 0.0831
Plasmodium falciparum cGMP-specific phosphodiesterase 0.024 0.0163 0.2689
Echinococcus multilocularis dna polymerase eta 0.005 0.0011 0.0028
Trichomonas vaginalis calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase, putative 0.024 0.0163 0.1335
Toxoplasma gondii thioredoxin reductase 0.0099 0.005 0.1074
Onchocerca volvulus 0.0168 0.0106 0.053
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0861 0.0663 0.5419
Loa Loa (eye worm) thioredoxin reductase 0.0099 0.005 0.0141
Echinococcus multilocularis cAMP and cAMP inhibited cGMP 3',5' cyclic 0.4737 0.378 1
Trypanosoma brucei polo-like protein kinase 0.0105 0.0055 0.0831
Brugia malayi 3'5'-cyclic nucleotide phosphodiesterase family protein 0.2435 0.1929 0.5103
Echinococcus granulosus cAMP and cAMP inhibited cGMP 3'5' cyclic 0.4737 0.378 1
Trichomonas vaginalis cGMP-inhibited 3,5-cyclic phosphodiesterase, putative 0.0861 0.0663 0.5419
Brugia malayi Probable 3',5'-cyclic phosphodiesterase C32E12.2, putative 0.4737 0.378 1
Brugia malayi O-methyltransferase 0.1294 0.1012 0.2676
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0861 0.0663 0.5419
Schistosoma mansoni o-methyltransferase 0.1294 0.1012 0.5244
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.024 0.0163 0.3474
Schistosoma mansoni 6-phosphofructokinase 0.012 0.0067 0.0348
Trichomonas vaginalis conserved hypothetical protein 0.0621 0.047 0.3843
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0861 0.0663 1
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative 0.0861 0.0663 0.5419
Loa Loa (eye worm) hypothetical protein 0.4497 0.3587 1

Activities

Activity type Activity value Assay description Source Reference
Ki (binding) = 1.1 nM Binding affinity against delta opioid receptor in mouse hot plate test ChEMBL. 15482911
Ki (binding) = 2.3 nM Binding affinity against mu opioid receptor in mouse hot plate test ChEMBL. 15482911
Ki (binding) = 2.3 nM Binding affinity against mu opioid receptor in mouse hot plate test ChEMBL. 15482911

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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