Detailed information for compound 1600681

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 398.267 | Formula: C15H13Cl2N5O2S
  • H donors: 4 H acceptors: 4 LogP: 3.19 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: OCCNc1nc2sc(c(c2c(n1)c1ccc(c(c1)Cl)Cl)N)C(=O)N
  • InChi: 1S/C15H13Cl2N5O2S/c16-7-2-1-6(5-8(7)17)11-9-10(18)12(13(19)24)25-14(9)22-15(21-11)20-3-4-23/h1-2,5,23H,3-4,18H2,(H2,19,24)(H,20,21,22)
  • InChiKey: BCALWAGTQCFXQT-UHFFFAOYSA-N  

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 4D, cAMP-specific Starlite/ChEMBL References
Homo sapiens phosphodiesterase 4A, cAMP-specific References
Homo sapiens B-Raf proto-oncogene, serine/threonine kinase Starlite/ChEMBL References
Homo sapiens phosphodiesterase 4B, cAMP-specific References
Homo sapiens phosphodiesterase 4C, cAMP-specific References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein Get druggable targets OG5_128242 All targets in OG5_128242
Schistosoma japonicum cAMP-specific 3',5'-cyclic phosphodiesterase, isoform F, putative Get druggable targets OG5_128242 All targets in OG5_128242
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase Get druggable targets OG5_128242 All targets in OG5_128242
Brugia malayi Raf kinase Get druggable targets OG5_130459 All targets in OG5_130459
Schistosoma japonicum cAMP-specific 3',5'-cyclic phosphodiesterase 4C, putative Get druggable targets OG5_128242 All targets in OG5_128242
Loa Loa (eye worm) cyclic AMP specific phosphodiesterase PDE4D5A Get druggable targets OG5_128242 All targets in OG5_128242
Schistosoma japonicum cAMP-specific 3',5'-cyclic phosphodiesterase 4D, putative Get druggable targets OG5_128242 All targets in OG5_128242
Echinococcus granulosus raf serine:threonine protein kinase Get druggable targets OG5_130459 All targets in OG5_130459
Cryptosporidium parvum membrane associated HD superfamily cyclic nucleotide phosphodiesterase domain containing protein Get druggable targets OG5_128242 All targets in OG5_128242
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase Get druggable targets OG5_128242 All targets in OG5_128242
Echinococcus multilocularis raf serine:threonine protein kinase Get druggable targets OG5_130459 All targets in OG5_130459
Loa Loa (eye worm) raf kinase Get druggable targets OG5_130459 All targets in OG5_130459
Schistosoma japonicum IPR002073,3'5'-cyclic nucleotide phosphodiesterase,domain-containing Get druggable targets OG5_128242 All targets in OG5_128242
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase Get druggable targets OG5_128242 All targets in OG5_128242
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase Get druggable targets OG5_128242 All targets in OG5_128242
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128242 All targets in OG5_128242
Brugia malayi Probable 3',5'-cyclic phosphodiesterase R153.1, putative Get druggable targets OG5_128242 All targets in OG5_128242
Schistosoma japonicum cAMP-specific 3',5'-cyclic phosphodiesterase 4D, putative Get druggable targets OG5_128242 All targets in OG5_128242
Loa Loa (eye worm) TKL/RAF/RAF protein kinase Get druggable targets OG5_130459 All targets in OG5_130459
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase Get druggable targets OG5_128242 All targets in OG5_128242
Neospora caninum cAMP-specific phosphodiesterase, putative Get druggable targets OG5_128242 All targets in OG5_128242
Schistosoma mansoni serine/threonine protein kinase Get druggable targets OG5_130459 All targets in OG5_130459
Schistosoma japonicum ko:K04365 B-Raf proto-oncogene serine/threonine-protein kinase, putative Get druggable targets OG5_130459 All targets in OG5_130459
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase Get druggable targets OG5_128242 All targets in OG5_128242
Cryptosporidium hominis hypothetical protein Get druggable targets OG5_128242 All targets in OG5_128242
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase Get druggable targets OG5_128242 All targets in OG5_128242
Giardia lamblia CAMP-specific 3,5-cyclic phosphodiesterase 4B Get druggable targets OG5_128242 All targets in OG5_128242

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
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0054 0.0529 0.348
Plasmodium falciparum cGMP-specific phosphodiesterase 0.0054 0.0529 1
Schistosoma mansoni cgmp-dependent 35-cyclic phosphodiesterase 0.0054 0.0529 0.0463
Trypanosoma cruzi hypothetical protein, conserved 0.0054 0.0529 0.0518
Mycobacterium ulcerans thioesterase TesA 0.0173 0.3394 0.4682
Chlamydia trachomatis 3-oxoacyl-ACP synthase 0.0052 0.0475 0.5
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0054 0.0529 0.0057
Schistosoma mansoni camp-specific cyclic nucleotide phosphodiesterase 0.0054 0.0529 0.0463
Trichomonas vaginalis conserved hypothetical protein 0.0063 0.0727 0.4782
Loa Loa (eye worm) calcium/calmodulin-stimulated cyclic nucleotide phosphodiesterase 0.0054 0.0529 0.0463
Mycobacterium tuberculosis Probable membrane bound polyketide synthase Pks6 0.031 0.671 1
Loa Loa (eye worm) beta-ketoacyl synthase domain-containing protein 0.0052 0.0475 0.0408
Brugia malayi Calcitonin receptor-like protein seb-1 0.0038 0.0146 0.0089
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSB 0.0167 0.3251 0.4155
Trypanosoma brucei polo-like protein kinase 0.0095 0.152 1
Brugia malayi Probable 3',5'-cyclic phosphodiesterase R153.1, putative 0.0054 0.0529 0.0531
Mycobacterium tuberculosis Polyketide synthetase MbtC (polyketide synthase) 0.0071 0.094 0.0795
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0095 0.152 1
Mycobacterium leprae PROBABLE THIOESTERASE TESA 0.0173 0.3394 0.4398
Echinococcus granulosus 3 oxoacyl acyl carrier protein synthase 0.0052 0.0475 0.0408
Plasmodium falciparum phosphodiesterase gamma, putative 0.0054 0.0529 1
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0054 0.0529 0.348
Onchocerca volvulus 0.0361 0.7943 0.9623
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0054 0.0529 0.0057
Echinococcus multilocularis raf serine:threonine protein kinase 0.0262 0.5535 0.5504
Brugia malayi 3'5'-cyclic nucleotide phosphodiesterase family protein 0.0054 0.0529 0.0531
Brugia malayi Heterochromatin protein 1 0.0054 0.0516 0.0516
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSC 0.022 0.4542 0.6337
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0054 0.0529 0.0057
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0054 0.0529 0.0518
Brugia malayi 3'5'-cyclic nucleotide phosphodiesterase family protein 0.0054 0.0529 0.0531
Echinococcus multilocularis cAMP and cAMP inhibited cGMP 3',5' cyclic 0.0054 0.0529 0.0463
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSE 0.0137 0.2532 0.2941
Plasmodium falciparum phosphodiesterase delta, putative 0.0054 0.0529 1
Trypanosoma brucei cAMP phosphodiesterase A, putative 0.0054 0.0529 0.0518
Plasmodium vivax phosphodiesterase gamma, putative 0.0054 0.0529 1
Trichomonas vaginalis chromobox protein, putative 0.0054 0.0516 0.3391
Trichomonas vaginalis CAMK family protein kinase 0.0047 0.0357 0.2348
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.0447 1 1
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0054 0.0529 0.0057
Mycobacterium leprae Polyketide synthase Pks13 0.031 0.671 1
Trichomonas vaginalis CAMK family protein kinase 0.0095 0.152 1
Trichomonas vaginalis CAMK family protein kinase 0.0095 0.152 1
Echinococcus multilocularis calcium:calmodulin dependent 3',5' cyclic 0.0054 0.0529 0.0463
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0054 0.0529 0.348
Schistosoma mansoni high-affinity cgmp-specific 35-cyclic phosphodiesterase 0.0054 0.0529 0.0463
Brugia malayi Probable 3',5'-cyclic phosphodiesterase R153.1, putative 0.0392 0.8687 0.9963
Loa Loa (eye worm) hypothetical protein 0.0054 0.0529 0.0463
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0054 0.0529 0.348
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0054 0.0529 0.348
Trichomonas vaginalis chromobox protein, putative 0.0054 0.0516 0.3391
Trypanosoma brucei cAMP-specific phosphodiesterase 0.0054 0.0529 0.0518
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0054 0.0529 0.348
Loa Loa (eye worm) raf kinase 0.026 0.5504 0.5473
Trypanosoma brucei 3', 5'-cyclic nucleotide phosphodiesterase, putative 0.0054 0.0529 0.0518
Schistosoma mansoni chromobox protein 0.0054 0.0516 0.0449
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.0447 1 1
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsC 0.0208 0.423 0.6044
Trypanosoma cruzi cAMP-specific phosphodiesterase, putative 0.0054 0.0529 0.0518
Trichomonas vaginalis CAMK family protein kinase 0.0095 0.152 1
Echinococcus granulosus high affinity cAMP specific 3'5' cyclic 0.0054 0.0529 0.0463
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative 0.0054 0.0529 0.348
Mycobacterium ulcerans polyketide synthase 0.022 0.4542 0.6522
Leishmania major hypothetical protein, conserved 0.0054 0.0529 0.0518
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0054 0.0529 0.348
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsA 0.0208 0.423 0.6044
Loa Loa (eye worm) acyl carrier protein 0.0095 0.1522 0.1463
Mycobacterium ulcerans Type I modular polyketide synthase 0.0208 0.423 0.6023
Brugia malayi AMP-binding enzyme family protein 0.0194 0.3901 0.4429
Entamoeba histolytica serine/threonine protein kinase, putative 0.0095 0.152 0.5
Plasmodium falciparum 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0054 0.0529 1
Trichomonas vaginalis CAMK family protein kinase 0.0047 0.0357 0.2348
Brugia malayi Probable 3',5'-cyclic phosphodiesterase C32E12.2, putative 0.0054 0.0529 0.0531
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsE 0.0137 0.2532 0.3299
Mycobacterium ulcerans polyketide synthase MbtD 0.0064 0.0758 0.0454
Loa Loa (eye worm) hypothetical protein 0.0447 1 1
Brugia malayi oxidoreductase, zinc-binding dehydrogenase family protein 0.0393 0.872 1
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0054 0.0529 0.348
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0054 0.0529 0.348
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0054 0.0529 0.348
Mycobacterium ulcerans polyketide synthase Pks9 0.0137 0.2532 0.3299
Onchocerca volvulus Fatty acid synthase homolog 0.0374 0.8254 1
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0054 0.0529 0.0057
Mycobacterium tuberculosis Polyketide synthase Pks2 0.0201 0.4077 0.5799
Plasmodium falciparum 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0054 0.0529 1
Mycobacterium tuberculosis Probable fatty acid synthase Fas (fatty acid synthetase) 0.0065 0.0791 0.0558
Mycobacterium tuberculosis Probable polyketide synthase Pks1 0.0149 0.2818 0.3791
Schistosoma mansoni kinase 0.0048 0.0387 0.032
Toxoplasma gondii type I fatty acid synthase, putative 0.022 0.4542 0.4269
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0054 0.0529 0.0518
Schistosoma mansoni chromobox protein 0.0054 0.0516 0.0449
Loa Loa (eye worm) heterochromatin protein 1 0.0054 0.0516 0.0449
Mycobacterium leprae Probable polyketide synthase Pks1 0.022 0.4542 0.6337
Trichomonas vaginalis conserved hypothetical protein 0.0054 0.0529 0.348
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0054 0.0529 0.0463
Mycobacterium tuberculosis Probable polyketide synthase Pks8 0.017 0.3317 0.4587
Schistosoma mansoni calcium/calmodulin-dependent 35-cyclic nucleotide phosphodiesterase 0.0054 0.0529 0.0463
Mycobacterium tuberculosis Polyketide synthetase MbtD (polyketide synthase) 0.0064 0.0758 0.0505
Trichomonas vaginalis CAMK family protein kinase 0.0095 0.152 1
Trypanosoma cruzi cAMP phosphodiesterase A, putative 0.0054 0.0529 0.0518
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0054 0.0529 0.348
Leishmania major hypothetical protein, conserved 0.0063 0.0727 0.241
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsD 0.0208 0.423 0.6044
Echinococcus multilocularis high affinity cgmp specific 3' 5' cyclic 0.0054 0.0529 0.0463
Echinococcus granulosus chromobox protein 1 0.0054 0.0516 0.0449
Plasmodium vivax cyclic nucleotide phosphodiesterase, putative 0.0054 0.0529 1
Trypanosoma brucei 3', 5'-cyclic nucleotide phosphodiesterase, putative 0.0054 0.0529 0.0518
Echinococcus granulosus calcium:calmodulin dependent 3'5' cyclic 0.0054 0.0529 0.0463
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0095 0.152 0.1461
Mycobacterium tuberculosis Probable multifunctional mycocerosic acid synthase membrane-associated Mas 0.022 0.4542 0.6541
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0054 0.0529 0.348
Trypanosoma cruzi hypothetical protein, conserved 0.0054 0.0529 0.0518
Mycobacterium ulcerans Type I modular polyketide synthase 0.0208 0.423 0.6023
Mycobacterium tuberculosis Hypothetical protein 0.0063 0.0727 0.0455
Schistosoma mansoni camp/cgmp cyclic nucleotide phosphodiesterase 0.0054 0.0529 0.0463
Onchocerca volvulus 0.0194 0.3901 0.4726
Trypanosoma cruzi hypothetical protein, conserved 0.0054 0.0529 0.0518
Trichomonas vaginalis cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative 0.0054 0.0529 0.348
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0054 0.0529 0.348
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0095 0.152 0.1461
Echinococcus multilocularis high affinity cAMP specific 3',5' cyclic 0.0054 0.0529 0.0463
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.0392 0.8687 0.8678
Loa Loa (eye worm) cyclic AMP specific phosphodiesterase PDE4D5A 0.0392 0.8687 0.8678
Brugia malayi Methyltransferase-like protein 4 0.0063 0.0727 0.076
Mycobacterium ulcerans multifunctional mycocerosic acid synthase membrane-associated Mas 0.022 0.4542 0.6522
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0054 0.0529 0.0518
Plasmodium falciparum cGMP-specific phosphodiesterase 0.0054 0.0529 1
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0054 0.0529 0.348
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0054 0.0529 0.0057
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0054 0.0529 0.348
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0054 0.0529 0.0463
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0054 0.0529 0.348
Giardia lamblia Kinase, PLK 0.0095 0.152 0.1046
Leishmania major cAMP-specific phosphodiesterase, putative 0.0054 0.0529 0.0518
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0054 0.0529 0.348
Onchocerca volvulus Serine\/threonine kinase homolog 0.0095 0.152 0.1842
Loa Loa (eye worm) hypothetical protein 0.0054 0.0529 0.0463
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0054 0.0529 0.348
Brugia malayi AMP-binding enzyme family protein 0.0064 0.0758 0.0796
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsD 0.0208 0.423 0.6023
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0054 0.0529 0.0057
Trichomonas vaginalis cGMP-inhibited 3,5-cyclic phosphodiesterase, putative 0.0054 0.0529 0.348
Echinococcus multilocularis chromobox protein 1 0.0054 0.0516 0.0449
Trypanosoma cruzi cAMP phosphodiesterase A, putative 0.0054 0.0529 0.0518
Loa Loa (eye worm) hypothetical protein 0.0054 0.0529 0.0463
Trypanosoma cruzi hypothetical protein, conserved 0.0054 0.0529 0.0518
Loa Loa (eye worm) hypothetical protein 0.0038 0.0146 0.0077
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0054 0.0529 0.0057
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0054 0.0529 0.348
Plasmodium vivax 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0054 0.0529 1
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0054 0.0529 0.0057
Trichomonas vaginalis conserved hypothetical protein 0.0054 0.0529 0.348
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0054 0.0529 0.0057
Trichomonas vaginalis calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0054 0.0529 0.348
Schistosoma mansoni serine/threonine protein kinase 0.0095 0.152 0.1461
Mycobacterium ulcerans Type I modular polyketide synthase 0.0208 0.423 0.6023
Trichomonas vaginalis cGMP-inhibited 3,5-cyclic phosphodiesterase, putative 0.0054 0.0529 0.348
Echinococcus granulosus dual 3'5' cyclic AMP and GMP phosphodiesterase 0.0054 0.0529 0.0463
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0054 0.0529 0.0057
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0054 0.0529 0.0057
Echinococcus granulosus calcium:calmodulin dependent 3'5' cyclic 0.0054 0.0529 0.0463
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSD 0.0208 0.423 0.581
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0095 0.152 0.1461
Plasmodium vivax 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0054 0.0529 1
Schistosoma mansoni serine/threonine protein kinase 0.0262 0.5535 0.5504
Trichomonas vaginalis CAMK family protein kinase 0.0095 0.152 1
Mycobacterium ulcerans fatty acid synthase Fas 0.0065 0.0791 0.0508
Trypanosoma cruzi cyclic nucleotide phosphodiesterase 0.0054 0.0529 0.0518
Mycobacterium tuberculosis Phenyloxazoline synthase MbtB (phenyloxazoline synthetase) 0.0194 0.3901 0.5519
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0054 0.0529 0.348
Echinococcus multilocularis calcium:calmodulin dependent 3',5' cyclic 0.0054 0.0529 0.0463
Mycobacterium tuberculosis Probable polyketide synthase Pks7 0.022 0.4542 0.6541
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0054 0.0529 0.348
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0054 0.0529 0.0518
Loa Loa (eye worm) PDE1B protein 0.0054 0.0529 0.0463
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSA 0.0208 0.423 0.581
Echinococcus multilocularis 3 oxoacyl (acyl carrier protein) synthase 0.0052 0.0475 0.0408
Mycobacterium tuberculosis Probable polyketide synthase Pks9 0.0118 0.2067 0.2593
Loa Loa (eye worm) AMP-binding enzyme family protein 0.0194 0.3901 0.3858
Echinococcus granulosus chromobox protein 1 0.0054 0.0516 0.0449
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0054 0.0529 0.348
Toxoplasma gondii beta-ketoacyl synthase, N-terminal domain-containing protein 0.0135 0.2469 0.2093
Trypanosoma brucei cAMP-specific phosphodiesterase, putative 0.0054 0.0529 0.0518
Echinococcus multilocularis chromobox protein 1 0.0054 0.0516 0.0449
Trypanosoma brucei cAMP-specific phosphodiesterase 0.0054 0.0529 0.0518
Mycobacterium tuberculosis Polyketide synthase Pks12 0.022 0.4542 0.6541
Brugia malayi Raf kinase 0.0253 0.5315 0.6064
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0054 0.0529 0.0057
Brugia malayi Beta-ketoacyl synthase, N-terminal domain containing protein 0.0052 0.0475 0.0469
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0054 0.0529 0.348
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0054 0.0529 0.348
Trichomonas vaginalis cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative 0.0054 0.0529 0.348
Mycobacterium ulcerans polyketide synthase Pks13 0.031 0.671 1
Trichomonas vaginalis CAMK family protein kinase 0.0095 0.152 1
Leishmania major hypothetical protein, conserved 0.0054 0.0529 0.0518
Schistosoma mansoni high-affinity cgmp-specific 35-cyclic phosphodiesterase 0.0054 0.0529 0.0463
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.0392 0.8687 0.8678
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0038 0.0146 0.0077
Brugia malayi 3'5'-cyclic nucleotide phosphodiesterase family protein 0.0054 0.0529 0.0531
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0447 1 1
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0054 0.0529 0.0463
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0054 0.0529 0.348
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0054 0.0529 0.348
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0054 0.0529 0.0057
Toxoplasma gondii AMP-binding enzyme domain-containing protein 0.0105 0.175 0.1339
Brugia malayi Probable 3',5'-cyclic phosphodiesterase T04D3.3, putative 0.0054 0.0529 0.0531
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0054 0.0529 0.348
Trypanosoma cruzi polo-like protein kinase, putative 0.0095 0.152 1
Mycobacterium tuberculosis Polyketide synthase Pks13 0.031 0.671 1
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.0447 1 1
Toxoplasma gondii type I fatty acid synthase, putative 0.0148 0.2785 0.2426
Echinococcus granulosus raf serine:threonine protein kinase 0.0262 0.5535 0.5504
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0054 0.0529 0.348
Schistosoma mansoni high-affinity cgmp-specific 35-cyclic phosphodiesterase 0.0054 0.0529 0.0463
Echinococcus granulosus cAMP and cAMP inhibited cGMP 3'5' cyclic 0.0054 0.0529 0.0463
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0054 0.0529 0.348
Mycobacterium ulcerans thioesterase 0.0173 0.3394 0.4682
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0054 0.0529 0.348
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative 0.0054 0.0529 0.348
Wolbachia endosymbiont of Brugia malayi 3-oxoacyl-ACP synthase 0.0052 0.0475 0.5
Loa Loa (eye worm) fatty acid synthase 0.0205 0.4163 0.4123
Leishmania major cAMP phosphodiesterase A, putative;with=GeneDB:LinJ18_V3.1100 0.0054 0.0529 0.0518
Mycobacterium tuberculosis Conserved protein 0.0063 0.0727 0.0455
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0054 0.0529 0.348
Mycobacterium leprae Probable multifunctional mycocerosic acid synthase membrane associated enzyme Mas 0.022 0.4542 0.6337
Loa Loa (eye worm) hypothetical protein 0.0116 0.2026 0.197
Trypanosoma cruzi hypothetical protein, conserved 0.0054 0.0529 0.0518
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0054 0.0529 0.0057
Echinococcus granulosus high affinity cgmp specific 3' 5' cyclic 0.0054 0.0529 0.0463
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsA 0.0167 0.3251 0.4452
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0054 0.0529 0.0057
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0054 0.0529 0.348
Trypanosoma brucei hypothetical protein, conserved 0.0054 0.0529 0.0518
Loa Loa (eye worm) hypothetical protein 0.0349 0.7639 0.7623
Schistosoma mansoni 3-oxoacyl-[ACP] synthase 0.0052 0.0475 0.0408
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsC 0.022 0.4542 0.6522
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0054 0.0529 0.348
Trypanosoma cruzi polo-like protein kinase, putative 0.0095 0.152 1
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0447 1 1
Giardia lamblia CAMP-specific 3,5-cyclic phosphodiesterase 4B 0.0447 1 1
Mycobacterium ulcerans polyketide synthase 0.0208 0.423 0.6023
Schistosoma mansoni methyltransferase-related 0.0063 0.0727 0.0662
Trichomonas vaginalis conserved hypothetical protein 0.0054 0.0529 0.348
Brugia malayi Beta-ketoacyl synthase, N-terminal domain containing protein 0.0208 0.423 0.481
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0054 0.0529 0.348
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0054 0.0529 0.0057
Mycobacterium tuberculosis Probable thioesterase TesA 0.0173 0.3394 0.4711
Trypanosoma cruzi hypothetical protein, conserved 0.0054 0.0529 0.0518
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsB 0.0167 0.3251 0.4452
Mycobacterium tuberculosis Probable polyketide synthase Pks15 0.0084 0.1244 0.128
Trichomonas vaginalis CAMK family protein kinase 0.0095 0.152 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0038 0.0146 0.0089
Echinococcus multilocularis dual 3',5' cyclic AMP and GMP phosphodiesterase 0.0054 0.0529 0.0463
Mycobacterium tuberculosis Probable polyketide synthase Pks5 0.0201 0.4077 0.5799
Brugia malayi serine/threonine-protein kinase plk-2 0.0095 0.152 0.1677
Loa Loa (eye worm) TKL/RAF/RAF protein kinase 0.0148 0.2799 0.2749
Giardia lamblia Methyltransferase like 2 0.0063 0.0727 0.0209
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0054 0.0529 0.348
Trichomonas vaginalis cAMP/cGMP cyclic nucleotide phosphodiesterase, putative 0.0054 0.0529 0.348

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 3.72 uM Inhibition of PDE4 purified from human U937 cells after 30 mins ChEMBL. 22137342
IC50 (binding) = 7.91 uM Inhibition of B-Raf in human A375 cells assessed as inhibition of phosphorylation of MEK1/2 by meso scale assay ChEMBL. 22137342

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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