Detailed information for compound 947619

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 344.611 | Formula: C12H7BrClNO2S
  • H donors: 0 H acceptors: 2 LogP: 5.14 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccc(c(c1)[N+](=O)[O-])Sc1ccccc1Br
  • InChi: 1S/C12H7BrClNO2S/c13-9-3-1-2-4-11(9)18-12-6-5-8(14)7-10(12)15(16)17/h1-7H
  • InChiKey: UFVJFFJOHXFYJP-UHFFFAOYSA-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
Homo sapiens phosphodiesterase 7B Starlite/ChEMBL References
Homo sapiens phosphodiesterase 7A Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus granulosus high affinity cAMP specific 3'5' cyclic Get druggable targets OG5_133100 All targets in OG5_133100
Echinococcus multilocularis high affinity cAMP specific 3',5' cyclic Get druggable targets OG5_133100 All targets in OG5_133100
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein phosphodiesterase 7B 450 aa 410 aa 28.3 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0061 0.0397 0.2977
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0027 0.0023 0.0008
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0027 0.0023 0.0008
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0077 0.0567 0.203
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0027 0.0023 0.0015
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0027 0.0023 0.0008
Trypanosoma brucei metallo-peptidase, Clan MA(E) Family M1 0.0077 0.0567 0.4322
Schistosoma mansoni DNA polymerase eta 0.0142 0.1284 0.2197
Echinococcus multilocularis transcription factor btf3 0.0039 0.0152 0.0152
Trichomonas vaginalis conserved hypothetical protein 0.0039 0.0152 0.0486
Trypanosoma cruzi hypothetical protein, conserved 0.0027 0.0023 0.0018
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0077 0.0567 0.0567
Trypanosoma cruzi hypothetical protein, conserved 0.0027 0.0023 0.0018
Loa Loa (eye worm) MBCTL1 0.006 0.0388 0.1576
Trypanosoma cruzi DNA polymerase kappa, putative 0.0061 0.0397 0.2977
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.004 0.0163 0.0163
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0103 0.086 0.086
Brugia malayi 3'5'-cyclic nucleotide phosphodiesterase family protein 0.0027 0.0023 0.0009
Brugia malayi mbt repeat family protein 0.0053 0.0307 0.1116
Echinococcus granulosus polycomb protein SCMH1 0.0053 0.0307 0.0307
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0027 0.0023 0.0008
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0027 0.0023 0.0015
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0053 0.0309 0.0529
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0027 0.0023 0.0008
Echinococcus multilocularis cAMP and cAMP inhibited cGMP 3',5' cyclic 0.0027 0.0023 0.0023
Trypanosoma brucei Aminopeptidase M1, putative 0.0077 0.0567 0.4322
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0103 0.086 0.1471
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0027 0.0023 0.0018
Trypanosoma brucei DNA polymerase IV, putative 0.0061 0.0397 0.2977
Echinococcus multilocularis SAM and MBT domain containing protein 0.0053 0.0307 0.0307
Trypanosoma brucei cAMP-specific phosphodiesterase 0.0027 0.0023 0.0018
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0103 0.086 0.1471
Trichomonas vaginalis cGMP-inhibited 3,5-cyclic phosphodiesterase, putative 0.0027 0.0023 0.0008
Brugia malayi TAR-binding protein 0.0131 0.1165 0.4464
Trypanosoma cruzi metallo-peptidase, clan MA(E), family M1, putative 0.0077 0.0567 0.4322
Schistosoma mansoni transcription factor btf3 0.0039 0.0152 0.0259
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0162 0.1503 0.5057
Schistosoma mansoni sex comb on midleg homolog 0.0053 0.0307 0.0525
Schistosoma mansoni high-affinity cgmp-specific 35-cyclic phosphodiesterase 0.0027 0.0023 0.004
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0061 0.0397 0.1616
Loa Loa (eye worm) TAR-binding protein 0.0131 0.1165 0.4918
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0162 0.1503 0.4459
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1 0.0077 0.0567 0.4322
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0027 0.0023 0.004
Onchocerca volvulus 0.0272 0.271 1
Schistosoma mansoni calcium/calmodulin-dependent 35-cyclic nucleotide phosphodiesterase 0.0027 0.0023 0.004
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0077 0.0567 0.0567
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0066 0.0453 0.0453
Brugia malayi Probable ClpP-like protease 0.0162 0.1503 0.5781
Brugia malayi RNA recognition motif domain containing protein 0.0131 0.1165 0.4464
Loa Loa (eye worm) hypothetical protein 0.0027 0.0023 0.001
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0027 0.0023 0.0008
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative 0.0027 0.0023 0.0008
Trypanosoma cruzi transcription factor btf3, putative 0.0039 0.0152 0.1035
Loa Loa (eye worm) hypothetical protein 0.005 0.0271 0.1074
Mycobacterium leprae PROBABLE NICOTINATE-NUCLEOTIDE ADENYLYLTRANSFERASE NADD (DEAMIDO-NAD(+) PYROPHOSPHORYLASE) (DEAMIDO-NAD(+) DIPHOSPHORYLASE) (NIC 0.0294 0.2952 1
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0027 0.0023 0.0008
Schistosoma mansoni high-affinity cgmp-specific 35-cyclic phosphodiesterase 0.0027 0.0023 0.004
Schistosoma mansoni bromodomain containing protein 0.007 0.0497 0.0851
Trypanosoma brucei DNA polymerase kappa, putative 0.0042 0.0188 0.1326
Trypanosoma cruzi metallo-peptidase, Clan MA(E) Family M1 0.005 0.0271 0.1979
Plasmodium vivax basic transcription factor 3b, putative 0.0039 0.0152 0.0446
Loa Loa (eye worm) hypothetical protein 0.0045 0.0222 0.0864
Plasmodium vivax phosphodiesterase gamma, putative 0.0027 0.0023 0.0008
Echinococcus granulosus tar DNA binding protein 0.0131 0.1165 0.1165
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0027 0.0023 0.0015
Echinococcus multilocularis calcium:calmodulin dependent 3',5' cyclic 0.0027 0.0023 0.0023
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0027 0.0021 0.0021
Trypanosoma cruzi DNA polymerase kappa, putative 0.0061 0.0397 0.2977
Plasmodium vivax nicotinate-nucleotide adenylyltransferase, putative 0.0294 0.2952 1
Schistosoma mansoni myelin transcription factor 1 myt1 0.006 0.0388 0.0663
Trypanosoma brucei hypothetical protein, conserved 0.0027 0.0023 0.0018
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0061 0.0397 0.0397
Brugia malayi Bromodomain containing protein 0.0043 0.0192 0.0669
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0027 0.0023 0.004
Echinococcus granulosus histone acetyltransferase MYST2 0.006 0.0388 0.0388
Loa Loa (eye worm) mbt repeat family protein 0.0053 0.0307 0.123
Trypanosoma cruzi aminopeptidase, putative 0.0077 0.0567 0.4322
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0162 0.1503 0.5
Mycobacterium ulcerans DNA polymerase IV 0.0061 0.0397 0.1283
Trichomonas vaginalis conserved hypothetical protein 0.0027 0.0023 0.0008
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0066 0.0453 0.0453
Trichomonas vaginalis conserved hypothetical protein 0.0027 0.0023 0.0008
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.0027 0.0023 0.0023
Schistosoma mansoni sex comb on midleg homolog 0.0053 0.0307 0.0525
Schistosoma mansoni peptidase Clp (S14 family) 0.0162 0.1503 0.2572
Trypanosoma brucei DNA polymerase kappa, putative 0.0042 0.0188 0.1326
Schistosoma mansoni family M1 non-peptidase homologue (M01 family) 0.005 0.0271 0.0463
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0027 0.0023 0.0015
Trypanosoma brucei DNA polymerase kappa, putative 0.0061 0.0397 0.2977
Trichomonas vaginalis set domain proteins, putative 0.0272 0.271 1
Echinococcus granulosus high affinity cgmp specific 3' 5' cyclic 0.0027 0.0023 0.0023
Leishmania major aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1 0.0077 0.0567 0.4322
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0027 0.0023 0.0008
Echinococcus granulosus histone lysine methyltransferase setb 0.0053 0.0309 0.0309
Loa Loa (eye worm) hypothetical protein 0.0053 0.0309 0.1239
Brugia malayi PHD-finger family protein 0.0028 0.0029 0.0031
Schistosoma mansoni tar DNA-binding protein 0.0131 0.1165 0.1994
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.004 0.0163 0.0163
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0027 0.0023 0.0008
Loa Loa (eye worm) hypothetical protein 0.0184 0.1743 0.74
Loa Loa (eye worm) hypothetical protein 0.0043 0.0193 0.074
Plasmodium vivax SET domain protein, putative 0.0034 0.0101 0.0274
Trypanosoma cruzi transcription factor btf3, putative 0.0039 0.0152 0.1035
Trypanosoma brucei DNA polymerase kappa, putative 0.0061 0.0397 0.2977
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0027 0.0023 0.0008
Leishmania major DNA polymerase eta, putative 0.0142 0.1284 1
Brugia malayi Pre-SET motif family protein 0.0239 0.2348 0.9076
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0027 0.0023 0.0015
Trypanosoma cruzi hypothetical protein, conserved 0.0027 0.0023 0.0018
Echinococcus multilocularis aminopeptidase N 0.0261 0.2585 0.2585
Toxoplasma gondii NAC domain-containing protein 0.0039 0.0152 0.0882
Trypanosoma brucei DNA polymerase IV, putative 0.0061 0.0397 0.2977
Plasmodium falciparum nicotinamide/nicotinic acid mononucleotide adenylyltransferase 0.0294 0.2952 1
Plasmodium falciparum phosphodiesterase delta, putative 0.0027 0.0023 0.0008
Trypanosoma brucei unspecified product 0.0042 0.0188 0.1326
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.0106 0.0891 0.2115
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0077 0.0567 0.0567
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0027 0.0023 0.0008
Loa Loa (eye worm) aminopeptidase N 0.0077 0.0567 0.2346
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.0027 0.0023 0.0023
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0027 0.0023 0.0008
Loa Loa (eye worm) RNA binding protein 0.0131 0.1165 0.4918
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0077 0.0567 0.0567
Loa Loa (eye worm) hypothetical protein 0.0053 0.0307 0.123
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0061 0.0397 0.1398
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.006 0.0388 0.0388
Brugia malayi 3'5'-cyclic nucleotide phosphodiesterase family protein 0.0027 0.0023 0.0009
Onchocerca volvulus 0.0053 0.0307 0.1064
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0034 0.0101 0.0173
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0027 0.0023 0.0015
Schistosoma mansoni camp/cgmp cyclic nucleotide phosphodiesterase 0.0027 0.0023 0.004
Brugia malayi Probable 3',5'-cyclic phosphodiesterase T04D3.3, putative 0.0027 0.0023 0.0009
Echinococcus granulosus calcium:calmodulin dependent 3'5' cyclic 0.0027 0.0023 0.0023
Trypanosoma cruzi hypothetical protein, conserved 0.0027 0.0023 0.0018
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.0027 0.0023 0.0023
Schistosoma mansoni leukotriene A4 hydrolase (M01 family) 0.0027 0.0021 0.0036
Trypanosoma brucei DNA polymerase kappa, putative 0.0061 0.0397 0.2977
Brugia malayi ImpB/MucB/SamB family protein 0.0061 0.0397 0.1467
Echinococcus multilocularis calcium:calmodulin dependent 3',5' cyclic 0.0027 0.0023 0.0023
Trypanosoma brucei transcription factor BTF3, putative 0.0039 0.0152 0.1035
Loa Loa (eye worm) hypothetical protein 0.0027 0.0023 0.001
Leishmania major DNA polymerase eta, putative 0.01 0.082 0.6331
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0027 0.0023 0.0008
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0103 0.086 0.086
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0053 0.0307 0.1064
Echinococcus granulosus dna polymerase kappa 0.0061 0.0397 0.0397
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0027 0.0021 0.0021
Trypanosoma brucei DNA polymerase IV, putative 0.0061 0.0397 0.2977
Entamoeba histolytica deoxycytidyl transferase, putative 0.0061 0.0397 0.5909
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0077 0.0567 0.0567
Giardia lamblia DINP protein human, muc B family 0.0061 0.0397 1
Plasmodium falciparum phosphodiesterase gamma, putative 0.0027 0.0023 0.0008
Loa Loa (eye worm) ICD-1 protein 0.0039 0.0152 0.0562
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0103 0.086 0.1471
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0027 0.0023 0.0015
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0027 0.0023 0.0018
Brugia malayi ImpB/MucB/SamB family protein 0.0142 0.1284 0.4926
Plasmodium vivax cyclic nucleotide phosphodiesterase, putative 0.0027 0.0023 0.0008
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0103 0.086 0.086
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0027 0.0023 0.0008
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0209 0.2019 0.2019
Echinococcus multilocularis dna polymerase eta 0.0142 0.1284 0.1284
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0027 0.0023 0.0008
Echinococcus granulosus calcium:calmodulin dependent 3'5' cyclic 0.0027 0.0023 0.0023
Echinococcus granulosus cAMP and cAMP inhibited cGMP 3'5' cyclic 0.0027 0.0023 0.0023
Trypanosoma brucei 3', 5'-cyclic nucleotide phosphodiesterase, putative 0.0027 0.0023 0.0018
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0027 0.0023 0.0008
Loa Loa (eye worm) peptidase family M1 containing protein 0.0211 0.2039 0.8672
Loa Loa (eye worm) hypothetical protein 0.0027 0.0023 0.001
Echinococcus multilocularis high affinity cAMP specific 3',5' cyclic 0.0936 1 1
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0056 0.0338 0.108
Toxoplasma gondii hypothetical protein 0.0056 0.0338 0.2136
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0027 0.0023 0.0015
Loa Loa (eye worm) hypothetical protein 0.005 0.0271 0.1074
Brugia malayi Probable 3',5'-cyclic phosphodiesterase R153.1, putative 0.0027 0.0023 0.0009
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0061 0.0397 0.0679
Trypanosoma brucei DNA polymerase kappa, putative 0.0061 0.0397 0.2977
Onchocerca volvulus 0.0034 0.0101 0.0298
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0027 0.0023 0.0008
Echinococcus granulosus peptidase Clp S14 family 0.0106 0.0891 0.0891
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative 0.0027 0.0023 0.0008
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0027 0.0023 0.0018
Brugia malayi RNA binding protein 0.0131 0.1165 0.4464
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.005 0.0271 0.0271
Echinococcus granulosus transcription factor btf3 0.0039 0.0152 0.0152
Echinococcus granulosus aminopeptidase N 0.0261 0.2585 0.2585
Treponema pallidum hypothetical protein 0.0294 0.2952 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0101 0.0173
Schistosoma mansoni tar DNA-binding protein 0.0131 0.1165 0.1994
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0103 0.086 0.3604
Trypanosoma brucei 3', 5'-cyclic nucleotide phosphodiesterase, putative 0.0027 0.0023 0.0018
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0027 0.0023 0.0008
Trypanosoma brucei cAMP phosphodiesterase A, putative 0.0027 0.0023 0.0018
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0162 0.1503 0.5
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0077 0.0567 0.203
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0027 0.0023 0.0015
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0061 0.0397 0.0397
Plasmodium vivax 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0027 0.0023 0.0008
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0027 0.0023 0.0015
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0162 0.1503 1
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0027 0.0023 0.0008
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0027 0.0023 0.0015
Brugia malayi Bromodomain containing protein 0.0083 0.064 0.2415
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0077 0.0567 0.0567
Plasmodium falciparum 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0027 0.0023 0.0008
Loa Loa (eye worm) hypothetical protein 0.006 0.0388 0.1576
Echinococcus multilocularis Peptidase M1, membrane alanine aminopeptidase, N terminal 0.0077 0.0567 0.0567
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0027 0.0023 0.0008
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0162 0.1503 0.1503
Onchocerca volvulus 0.0077 0.0567 0.203
Loa Loa (eye worm) hypothetical protein 0.0027 0.0023 0.001
Trypanosoma brucei DNA polymerase kappa, putative 0.0061 0.0397 0.2977
Trypanosoma brucei DNA polymerase kappa, putative 0.0042 0.0188 0.1326
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0103 0.086 0.3271
Trypanosoma brucei DNA polymerase kappa, putative 0.0061 0.0397 0.2977
Trypanosoma cruzi cyclic nucleotide phosphodiesterase 0.0027 0.0023 0.0018
Trypanosoma brucei DNA polymerase kappa, putative 0.0061 0.0397 0.2977
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0027 0.0023 0.0008
Plasmodium falciparum basic transcription factor 3b, putative 0.0039 0.0152 0.0446
Brugia malayi Probable 3',5'-cyclic phosphodiesterase C32E12.2, putative 0.0027 0.0023 0.0009
Trypanosoma cruzi DNA polymerase kappa, putative 0.0061 0.0397 0.2977
Onchocerca volvulus 0.0261 0.2585 0.9533
Trypanosoma brucei unspecified product 0.0061 0.0397 0.2977
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0034 0.0101 0.0541
Trichomonas vaginalis calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0027 0.0023 0.0008
Trichomonas vaginalis cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative 0.0027 0.0023 0.0008
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0027 0.0023 0.0015
Loa Loa (eye worm) hypothetical protein 0.0079 0.0588 0.2437
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0077 0.0567 0.0567
Loa Loa (eye worm) calcium/calmodulin-stimulated cyclic nucleotide phosphodiesterase 0.0027 0.0023 0.001
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0077 0.0567 0.0567
Loa Loa (eye worm) hypothetical protein 0.0047 0.0245 0.0965
Leishmania major hypothetical protein, conserved 0.0027 0.0023 0.0018
Echinococcus multilocularis high affinity cgmp specific 3' 5' cyclic 0.0027 0.0023 0.0023
Trichomonas vaginalis cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative 0.0027 0.0023 0.0008
Trypanosoma brucei DNA polymerase kappa, putative 0.0061 0.0397 0.2977
Leishmania major basic transcription factor 3a, putative 0.0039 0.0152 0.1035
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.006 0.0388 0.143
Schistosoma mansoni high-affinity cgmp-specific 35-cyclic phosphodiesterase 0.0027 0.0023 0.004
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0103 0.086 0.086
Plasmodium falciparum cGMP-specific phosphodiesterase 0.0027 0.0023 0.0008
Entamoeba histolytica aminopeptidase, putative 0.0077 0.0567 1
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0027 0.0023 0.0015
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0027 0.0023 0.0008
Schistosoma mansoni terminal deoxycytidyl transferase 0.0061 0.0397 0.0679
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0027 0.0023 0.0008
Brugia malayi beta-NAC-like protein 0.0039 0.0152 0.051
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0034 0.0101 0.0101
Brugia malayi Peptidase family M1 containing protein 0.0077 0.0567 0.2129
Echinococcus multilocularis tar DNA binding protein 0.0131 0.1165 0.1165
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0027 0.0023 0.0008
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0162 0.1503 0.5057
Trypanosoma cruzi DNA polymerase eta, putative 0.01 0.082 0.6331
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.006 0.0388 0.0388
Trypanosoma cruzi DNA polymerase kappa, putative 0.0061 0.0397 0.2977
Schistosoma mansoni cytosol alanyl aminopeptidase (M01 family) 0.0077 0.0567 0.097
Trypanosoma cruzi Aminopeptidase M1, putative 0.0077 0.0567 0.4322
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0027 0.0023 0.0008
Trichomonas vaginalis cGMP-inhibited 3,5-cyclic phosphodiesterase, putative 0.0027 0.0023 0.0008
Loa Loa (eye worm) PDE1B protein 0.0027 0.0023 0.001
Trypanosoma cruzi cAMP phosphodiesterase A, putative 0.0027 0.0023 0.0018
Trichomonas vaginalis conserved hypothetical protein 0.0039 0.0152 0.0486
Trichomonas vaginalis conserved hypothetical protein 0.0039 0.0152 0.0486
Trypanosoma brucei cAMP-specific phosphodiesterase, putative 0.0027 0.0023 0.0018
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0027 0.0023 0.0008
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0027 0.0023 0.0008
Mycobacterium ulcerans DNA polymerase IV 0.0061 0.0397 0.1283
Trichomonas vaginalis DNA polymerase eta, putative 0.0061 0.0397 0.1398
Echinococcus multilocularis polycomb protein SCMH1 0.0053 0.0307 0.0307
Trypanosoma brucei cAMP-specific phosphodiesterase 0.0027 0.0023 0.0018
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0027 0.0023 0.0008
Schistosoma mansoni camp-specific cyclic nucleotide phosphodiesterase 0.0027 0.0023 0.004
Schistosoma mansoni cgmp-dependent 35-cyclic phosphodiesterase 0.0027 0.0023 0.004
Echinococcus granulosus dual 3'5' cyclic AMP and GMP phosphodiesterase 0.0027 0.0023 0.0023
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0027 0.0023 0.0015
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0027 0.0023 0.0015
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.0027 0.0023 0.0023
Toxoplasma gondii ImpB/MucB/SamB family protein 0.01 0.082 0.5394
Trypanosoma brucei Aminopeptidase M1, putative 0.0077 0.0567 0.4322
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0056 0.0338 0.108
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0053 0.0309 0.0309
Leishmania major hypothetical protein, conserved 0.0027 0.0023 0.0018
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0027 0.0023 0.0008
Trichomonas vaginalis conserved hypothetical protein 0.0027 0.0023 0.0008
Brugia malayi 3'5'-cyclic nucleotide phosphodiesterase family protein 0.0027 0.0023 0.0009
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0162 0.1503 0.5057
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0027 0.0023 0.0008
Trichomonas vaginalis cAMP/cGMP cyclic nucleotide phosphodiesterase, putative 0.0027 0.0023 0.0008
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0162 0.1503 1
Loa Loa (eye worm) hypothetical protein 0.0142 0.1284 0.5427
Echinococcus granulosus geminin 0.0558 0.5845 0.5845
Schistosoma mansoni aminopeptidase PILS (M01 family) 0.0077 0.0567 0.097
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0162 0.1503 0.4459
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0209 0.2019 0.2019
Schistosoma mansoni hypothetical protein 0.0558 0.5845 1
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0027 0.0023 0.0008
Trypanosoma cruzi DNA polymerase eta, putative 0.0142 0.1284 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0053 0.0309 0.0529
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0162 0.1503 0.5057
Brugia malayi Pre-SET motif family protein 0.0034 0.0101 0.0313
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0027 0.0023 0.0015
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0027 0.0023 0.0008
Schistosoma mansoni hypothetical protein 0.0558 0.5845 1
Mycobacterium ulcerans bifunctional nicotinate-nucleotide adenylyltransferase NadD/hypothetical protein 0.0294 0.2952 1
Echinococcus multilocularis leukotriene A 4 hydrolase 0.0027 0.0021 0.0021
Schistosoma mansoni tar DNA-binding protein 0.0131 0.1165 0.1994
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0027 0.0023 0.0015
Echinococcus multilocularis geminin 0.0558 0.5845 0.5845
Brugia malayi mbt repeat family protein 0.0053 0.0307 0.1116
Brugia malayi Peptidase family M1 containing protein 0.0261 0.2585 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0061 0.0397 0.2977
Schistosoma mansoni aminopeptidase A (M01 family) 0.0027 0.0021 0.0036
Plasmodium vivax 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0027 0.0023 0.0008
Leishmania major cAMP-specific phosphodiesterase, putative 0.0027 0.0023 0.0018
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0027 0.0023 0.0008
Mycobacterium tuberculosis Probable nicotinate-nucleotide adenylyltransferase NadD (deamido-NAD(+) pyrophosphorylase) (deamido-NAD(+) diphosphorylase) (nic 0.0294 0.2952 1
Brugia malayi hypothetical protein 0.0077 0.0567 0.2129
Leishmania major cAMP phosphodiesterase A, putative;with=GeneDB:LinJ18_V3.1100 0.0027 0.0023 0.0018
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0027 0.0023 0.0018
Trypanosoma cruzi cAMP phosphodiesterase A, putative 0.0027 0.0023 0.0018
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0162 0.1503 0.5
Schistosoma mansoni Tata binding protein associated factor (M01 family) 0.0027 0.0021 0.0036
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0077 0.0567 0.0567
Echinococcus granulosus leukotriene A 4 hydrolase 0.0027 0.0021 0.0021
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0053 0.0307 0.0525
Loa Loa (eye worm) hypothetical protein 0.0162 0.1503 0.637
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0027 0.0023 0.0008
Plasmodium falciparum cGMP-specific phosphodiesterase 0.0027 0.0023 0.0008
Mycobacterium ulcerans aminopeptidase N PepN 0.0077 0.0567 0.1862
Trypanosoma brucei unspecified product 0.0042 0.0188 0.1326
Trypanosoma cruzi hypothetical protein, conserved 0.0027 0.0023 0.0018
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0239 0.2348 1
Echinococcus multilocularis histone acetyltransferase MYST2 0.006 0.0388 0.0388
Trypanosoma cruzi hypothetical protein, conserved 0.0027 0.0023 0.0018
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0027 0.0023 0.004
Trypanosoma brucei DNA polymerase eta, putative 0.0142 0.1284 1
Echinococcus granulosus SAM and MBT domain containing protein 0.0053 0.0307 0.0307
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.0106 0.0891 0.1932
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0027 0.0023 0.0015
Echinococcus multilocularis peptidase Clp (S14 family) 0.0106 0.0891 0.0891
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0162 0.1503 0.1503
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0033 0.0087 0.0087
Trypanosoma brucei DNA polymerase kappa, putative 0.0061 0.0397 0.2977
Echinococcus granulosus dna polymerase eta 0.0142 0.1284 0.1284
Loa Loa (eye worm) hypothetical protein 0.0234 0.2289 0.9746
Schistosoma mansoni tar DNA-binding protein 0.0131 0.1165 0.1994
Plasmodium falciparum 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0027 0.0023 0.0008
Echinococcus multilocularis dual 3',5' cyclic AMP and GMP phosphodiesterase 0.0027 0.0023 0.0023
Leishmania major DNA polymerase kappa, putative 0.0061 0.0397 0.2977
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0027 0.0023 0.004
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0027 0.0023 0.0008
Schistosoma mansoni hypothetical protein 0.0322 0.3264 0.5584
Trypanosoma cruzi cAMP-specific phosphodiesterase, putative 0.0027 0.0023 0.0018
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.0106 0.0891 0.1932
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0131 0.1165 0.4918
Schistosoma mansoni tar DNA-binding protein 0.0131 0.1165 0.1994
Echinococcus multilocularis dna polymerase kappa 0.0061 0.0397 0.0397

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 0.99 uM Inhibition of human recombinant PDE7A1 assessed as inhibition of hydrolysis of [3H]cAMP after 20 mins by scintillation proximity assay ChEMBL. 25264825
IC50 (binding) = 1.41 uM Inhibition of human recombinant PDE7B assessed as inhibition of hydrolysis of [3H]cAMP after 20 mins by scintillation proximity assay ChEMBL. 25264825
Inhibition (binding) = 30 % Inhibition of human recombinant PDE4B2 assessed at 10 uM after 60 mins by IMAP fluorescence polarization assay ChEMBL. 25264825
Inhibition (binding) = 44 % Inhibition of human recombinant PDE4D3 assessed at 10 uM after 60 mins by IMAP fluorescence polarization assay ChEMBL. 25264825
Inhibition (binding) = 60 % Inhibition of human recombinant PDE3A assessed as inhibition of hydrolysis of [3H]cAMP at 10 uM after 20 mins by scintillation proximity assay ChEMBL. 25264825
Inhibition (binding) = 79 % Inhibition of human recombinant PDE7A1 assessed as inhibition of hydrolysis of [3H]cAMP at 10 uM after 20 mins by scintillation proximity assay ChEMBL. 25264825
Inhibition (binding) = 92 % Inhibition of human recombinant PDE7B assessed as inhibition of hydrolysis of [3H]cAMP at 10 uM after 20 mins by scintillation proximity assay ChEMBL. 25264825

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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