Detailed information for compound 1823352

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 449.913 | Formula: C22H16ClN5O2S
  • H donors: 1 H acceptors: 5 LogP: 4.2 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccc(cc1c1nn2c(C)nnc2c2c1cccc2)NS(=O)(=O)c1ccccc1
  • InChi: 1S/C22H16ClN5O2S/c1-14-24-25-22-18-10-6-5-9-17(18)21(26-28(14)22)19-13-15(11-12-20(19)23)27-31(29,30)16-7-3-2-4-8-16/h2-13,27H,1H3
  • InChiKey: BNQATIQUTRDHJB-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

No synonyms found for this compound

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
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0219 0.0094 0.2036
Echinococcus granulosus high affinity cgmp specific 3' 5' cyclic 0.0219 0.0094 0.021
Echinococcus granulosus cAMP and cAMP inhibited cGMP 3'5' cyclic 0.6999 0.4467 1
Schistosoma mansoni mannose-1-phosphate guanyltransferase 0.0075 0.0001 0.0017
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0788 0.0461 1
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0219 0.0094 0.2036
Toxoplasma gondii GDP-D-mannose pyrophosphorylase 0.0075 0.0001 0.0005
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0788 0.0461 1
Schistosoma mansoni calcium/calmodulin-dependent 35-cyclic nucleotide phosphodiesterase 0.0219 0.0094 0.2036
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0788 0.0461 1
Trypanosoma cruzi GDP-mannose pyrophosphorylase 0.0075 0.0001 0.0017
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0219 0.0094 0.0538
Mycobacterium tuberculosis Two component sensor histidine kinase DosT 0.0569 0.0319 0.0319
Echinococcus granulosus dual 3'5' cyclic AMP and GMP phosphodiesterase 0.0788 0.0461 0.1031
Echinococcus multilocularis calcium:calmodulin dependent 3',5' cyclic 0.0219 0.0094 0.021
Brugia malayi GDP-mannose pyrophosphorylase B 0.0075 0.0001 0.0002
Schistosoma mansoni camp/cgmp cyclic nucleotide phosphodiesterase 0.0788 0.0461 1
Leishmania major hypothetical protein, conserved 0.0219 0.0094 0.2036
Trypanosoma cruzi Translation initiation factor eIF-2B subunit epsilon, putative 0.0075 0.0001 0.0017
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0788 0.0461 1
Loa Loa (eye worm) calcium/calmodulin-stimulated cyclic nucleotide phosphodiesterase 0.0219 0.0094 0.0217
Toxoplasma gondii hypothetical protein 0.0569 0.0319 0.1829
Plasmodium vivax mannose-1-phosphate guanyltransferase, putative 0.0075 0.0001 0.0025
Mycobacterium tuberculosis Two component sensor histidine kinase DevS 0.0569 0.0319 0.0319
Trypanosoma cruzi hypothetical protein, conserved 0.0219 0.0094 0.2036
Trypanosoma cruzi cAMP phosphodiesterase A, putative 0.0219 0.0094 0.2036
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0219 0.0094 0.0538
Loa Loa (eye worm) nucleotidyl transferase 0.0075 0.0001 0.0002
Loa Loa (eye worm) hypothetical protein 0.0219 0.0094 0.0217
Mycobacterium ulcerans hypothetical protein 0.2778 0.1744 0.1744
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0102 0.0018 0.0018
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0788 0.0461 1
Echinococcus granulosus high affinity cAMP specific 3'5' cyclic 0.0219 0.0094 0.021
Plasmodium vivax 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0219 0.0094 0.294
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0219 0.0094 0.2036
Loa Loa (eye worm) hypothetical protein 0.6211 0.3959 0.9152
Trypanosoma brucei hypothetical protein, conserved 0.0219 0.0094 0.2036
Brugia malayi Probable 3',5'-cyclic phosphodiesterase C32E12.2, putative 0.6999 0.4467 1
Loa Loa (eye worm) hypothetical protein 0.6779 0.4326 1
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0113 0.0025 0.0025
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0219 0.0094 0.2036
Trypanosoma brucei 3', 5'-cyclic nucleotide phosphodiesterase, putative 0.0219 0.0094 0.2036
Toxoplasma gondii hypothetical protein 0.0569 0.0319 0.1829
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0788 0.0461 1
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0788 0.0461 1
Trichomonas vaginalis conserved hypothetical protein 0.0569 0.0319 0.6927
Trypanosoma cruzi cAMP-specific phosphodiesterase, putative 0.0219 0.0094 0.2036
Brugia malayi 3'5'-cyclic nucleotide phosphodiesterase family protein 0.0219 0.0094 0.021
Mycobacterium ulcerans putative regulatory protein 0.0569 0.0319 0.0319
Trypanosoma brucei GDP-mannose pyrophosphorylase 0.0075 0.0001 0.0017
Trichomonas vaginalis conserved hypothetical protein 0.0219 0.0094 0.2036
Plasmodium falciparum mannose-1-phosphate guanyltransferase, putative 0.0075 0.0001 0.0025
Trypanosoma brucei cAMP-specific phosphodiesterase 0.0788 0.0461 1
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0219 0.0094 0.2036
Toxoplasma gondii GAF domain-containing protein 0.0569 0.0319 0.1829
Schistosoma mansoni hypothetical protein 0.0146 0.0046 0.1002
Plasmodium falciparum 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0219 0.0094 0.294
Giardia lamblia CAMP-specific 3,5-cyclic phosphodiesterase 4B 0.0219 0.0094 1
Schistosoma mansoni high-affinity cgmp-specific 35-cyclic phosphodiesterase 0.0219 0.0094 0.2036
Mycobacterium ulcerans hypothetical protein 0.2778 0.1744 0.1744
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0219 0.0094 0.2036
Brugia malayi 3'5'-cyclic nucleotide phosphodiesterase family protein 0.0788 0.0461 0.1031
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0788 0.0461 1
Chlamydia trachomatis acyl-ACP--UDP-N-acetylglucosamine O-acyltransferase 0.0074 0 0.5
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0219 0.0094 0.2036
Plasmodium falciparum phosphodiesterase gamma, putative 0.0219 0.0094 0.294
Toxoplasma gondii hypothetical protein 0.0569 0.0319 0.1829
Schistosoma mansoni high-affinity cgmp-specific 35-cyclic phosphodiesterase 0.0219 0.0094 0.2036
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0788 0.0461 1
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative 0.0788 0.0461 1
Plasmodium vivax 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0219 0.0094 0.294
Trichomonas vaginalis cAMP/cGMP cyclic nucleotide phosphodiesterase, putative 0.0788 0.0461 1
Trypanosoma cruzi hypothetical protein, conserved 0.0219 0.0094 0.2036
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0788 0.0461 1
Trypanosoma cruzi cAMP phosphodiesterase A, putative 0.0219 0.0094 0.2036
Trypanosoma cruzi hypothetical protein, conserved 0.0219 0.0094 0.2036
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0788 0.0461 1
Mycobacterium ulcerans molybdopterin-guanine dinucleotide biosynthesis protein A 0.2778 0.1744 0.1744
Echinococcus multilocularis high affinity cAMP specific 3',5' cyclic 0.0219 0.0094 0.021
Trypanosoma brucei 3', 5'-cyclic nucleotide phosphodiesterase, putative 0.0219 0.0094 0.2036
Mycobacterium leprae conserved hypothetical protein 0.0569 0.0319 0.0319
Brugia malayi Probable 3',5'-cyclic phosphodiesterase T04D3.3, putative 0.0219 0.0094 0.021
Echinococcus multilocularis calcium:calmodulin dependent 3',5' cyclic 0.0219 0.0094 0.021
Trypanosoma brucei cAMP phosphodiesterase A, putative 0.0219 0.0094 0.2036
Mycobacterium tuberculosis Conserved hypothetical protein 0.2778 0.1744 0.1744
Leishmania major cAMP-specific phosphodiesterase, putative 0.0219 0.0094 0.2036
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0219 0.0094 0.2036
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0113 0.0025 0.0025
Plasmodium falciparum 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0219 0.0094 0.294
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0113 0.0025 0.0025
Trichomonas vaginalis conserved hypothetical protein 0.0569 0.0319 0.6927
Trypanosoma cruzi GDP-mannose pyrophosphorylase 0.0075 0.0001 0.0017
Echinococcus multilocularis mannose 1 phosphate guanyltransferase beta 0.0075 0.0001 0.0002
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.0219 0.0094 0.021
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0788 0.0461 1
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0102 0.0018 0.0018
Trichomonas vaginalis calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0219 0.0094 0.2036
Toxoplasma gondii eukaryotic initiation factor-2B, gamma subunit, putative 0.2778 0.1744 1
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0219 0.0094 0.0538
Brugia malayi Probable 3',5'-cyclic phosphodiesterase R153.1, putative 0.0219 0.0094 0.021
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0219 0.0094 0.0538
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0788 0.0461 1
Schistosoma mansoni hypothetical protein 0.0146 0.0046 0.1002
Mycobacterium tuberculosis Probable oxidoreductase 0.0113 0.0025 0.0025
Echinococcus granulosus calcium:calmodulin dependent 3'5' cyclic 0.0219 0.0094 0.021
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0219 0.0094 0.0538
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0788 0.0461 1
Entamoeba histolytica translation initiation factor eIF-2B epsilon subunit, putative 0.0075 0.0001 1
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.0219 0.0094 0.021
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0219 0.0094 0.2036
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0788 0.0461 1
Giardia lamblia Hypothetical protein 0.0219 0.0094 1
Trypanosoma cruzi hypothetical protein, conserved 0.0219 0.0094 0.2036
Trichomonas vaginalis conserved hypothetical protein 0.0788 0.0461 1
Plasmodium vivax phosphodiesterase gamma, putative 0.0219 0.0094 0.294
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0788 0.0461 1
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0219 0.0094 0.0538
Trichomonas vaginalis glucose-1-phosphate thymidylyltransferase, putative 0.0075 0.0001 0.0017
Schistosoma mansoni high-affinity cgmp-specific 35-cyclic phosphodiesterase 0.0219 0.0094 0.2036
Giardia lamblia hypothetical protein 0.0219 0.0094 1
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0219 0.0094 0.0538
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0219 0.0094 0.2036
Trypanosoma cruzi hypothetical protein, conserved 0.0219 0.0094 0.2036
Echinococcus granulosus mannose 1 phosphate guanyltransferase 0.0075 0.0001 0.0002
Trichomonas vaginalis conserved hypothetical protein 0.0569 0.0319 0.6927
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0102 0.0018 0.0018
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative 0.0788 0.0461 1
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0219 0.0094 0.2036
Plasmodium vivax cyclic nucleotide phosphodiesterase, putative 0.0219 0.0094 0.294
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0219 0.0094 0.0538
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0788 0.0461 1
Loa Loa (eye worm) hypothetical protein 0.0219 0.0094 0.0217
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0102 0.0018 0.0018
Brugia malayi 3'5'-cyclic nucleotide phosphodiesterase family protein 0.0219 0.0094 0.021
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0788 0.0461 1
Trichomonas vaginalis conserved hypothetical protein 0.0219 0.0094 0.2036
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0219 0.0094 0.0538
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0788 0.0461 1
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0788 0.0461 1
Plasmodium falciparum cGMP-specific phosphodiesterase 0.0219 0.0094 0.294
Echinococcus multilocularis cAMP and cAMP inhibited cGMP 3',5' cyclic 0.6999 0.4467 1
Leishmania major cAMP phosphodiesterase A, putative;with=GeneDB:LinJ18_V3.1100 0.0219 0.0094 0.2036
Leishmania major hypothetical protein, conserved 0.0219 0.0094 0.2036
Mycobacterium tuberculosis Probable UDP-N-acetylglucosamine pyrophosphorylase GlmU 1.5575 1 1
Mycobacterium ulcerans bifunctional N-acetylglucosamine-1-phosphate uridyltransferase/glucosamine-1-phosphate acetyltransferase 1.5575 1 1
Schistosoma mansoni gdp-mannose pyrophosphorylase b isoform 2 0.0075 0.0001 0.0017
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0788 0.0461 1
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.0219 0.0094 0.021
Trypanosoma cruzi hypothetical protein, conserved 0.0219 0.0094 0.2036
Echinococcus multilocularis mannose 1 phosphate guanyltransferase 0.0075 0.0001 0.0002
Plasmodium falciparum cGMP-specific phosphodiesterase 0.0219 0.0094 0.294
Wolbachia endosymbiont of Brugia malayi N-acetylglucosamine-1-phosphate uridyltransferase 1.5575 1 1
Mycobacterium tuberculosis Probable reductase 0.0102 0.0018 0.0018
Echinococcus multilocularis geminin 0.0146 0.0046 0.0103
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0219 0.0094 0.0538
Treponema pallidum licC protein (licC) 0.2778 0.1744 0.5
Trypanosoma brucei cAMP-specific phosphodiesterase, putative 0.0219 0.0094 0.2036
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0219 0.0094 0.0538
Mycobacterium tuberculosis Probable dehydrogenase 0.0102 0.0018 0.0018
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0788 0.0461 1
Trypanosoma cruzi cyclic nucleotide phosphodiesterase 0.0219 0.0094 0.2036
Schistosoma mansoni cgmp-dependent 35-cyclic phosphodiesterase 0.0788 0.0461 1
Echinococcus granulosus geminin 0.0146 0.0046 0.0103
Leishmania major GDP-mannose pyrophosphorylase 0.0075 0.0001 0.0017
Trichomonas vaginalis conserved hypothetical protein 0.0569 0.0319 0.6927
Trichomonas vaginalis cGMP-inhibited 3,5-cyclic phosphodiesterase, putative 0.0788 0.0461 1
Mycobacterium ulcerans putative regulatory protein 0.0569 0.0319 0.0319
Loa Loa (eye worm) PDE1B protein 0.0219 0.0094 0.0217
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0788 0.0461 1
Mycobacterium tuberculosis Conserved hypothetical protein 0.2778 0.1744 0.1744
Echinococcus granulosus calcium:calmodulin dependent 3'5' cyclic 0.0219 0.0094 0.021
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0788 0.0461 1
Trichomonas vaginalis sugar-1-phosphate guanyl transferase, putative 0.0075 0.0001 0.0017
Loa Loa (eye worm) GDP-mannose pyrophosphorylase B 0.0075 0.0001 0.0002
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0219 0.0094 0.0538
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0219 0.0094 0.0538
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0219 0.0094 0.2036
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0219 0.0094 0.0538
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0788 0.0461 1
Echinococcus granulosus mannose 1 phosphate guanyltransferase beta 0.0075 0.0001 0.0002
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0788 0.0461 1
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0219 0.0094 0.0538
Trichomonas vaginalis cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative 0.0219 0.0094 0.2036
Trypanosoma brucei nucleotidyl transferase, putative 0.0075 0.0001 0.0017
Loa Loa (eye worm) hypothetical protein 0.0788 0.0461 0.1065
Echinococcus multilocularis dual 3',5' cyclic AMP and GMP phosphodiesterase 0.0788 0.0461 0.1031
Brugia malayi Nucleotidyl transferase family protein 0.0075 0.0001 0.0002
Trypanosoma brucei cAMP-specific phosphodiesterase 0.0788 0.0461 1
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0788 0.0461 1
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0219 0.0094 0.2036
Plasmodium falciparum GAF domain-related protein, putative 0.0569 0.0319 1
Trichomonas vaginalis cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative 0.0219 0.0094 0.2036
Schistosoma mansoni camp-specific cyclic nucleotide phosphodiesterase 0.0219 0.0094 0.2036
Plasmodium falciparum phosphodiesterase delta, putative 0.0219 0.0094 0.294
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.0219 0.0094 0.021
Loa Loa (eye worm) hypothetical protein 0.0219 0.0094 0.0217
Plasmodium vivax hypothetical protein, conserved 0.0569 0.0319 1
Chlamydia trachomatis UDP-3-O-acylglucosamine N-acyltransferase 0.0074 0 0.5
Mycobacterium ulcerans d-alpha-D-mannose-1-phosphate guanylyltransferase ManB 0.0075 0.0001 0.0001
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0219 0.0094 0.0538
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0219 0.0094 0.0538
Echinococcus multilocularis high affinity cgmp specific 3' 5' cyclic 0.0219 0.0094 0.021
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0788 0.0461 1
Trichomonas vaginalis cGMP-inhibited 3,5-cyclic phosphodiesterase, putative 0.0219 0.0094 0.2036
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0219 0.0094 0.0538
Mycobacterium ulcerans two component sensor histidine kinase DevS 0.0569 0.0319 0.0319
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0788 0.0461 1
Schistosoma mansoni glucosamine-1-phosphate N-acetyltransferase 0.0075 0.0001 0.0017
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0102 0.0018 0.0018
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0788 0.0461 1

Activities

Activity type Activity value Assay description Source Reference
Delta Tm (binding) = -0.54 degrees C Binding affinity to BRD9 bromodomain (unknown origin) assessed as change in melting temperature at 10 uM by differential scanning fluorimetric analysis ChEMBL. 24313754
Delta Tm (binding) = -0.24 degrees C Binding affinity to PCAF bromodomain (unknown origin) assessed as change in melting temperature at 10 uM by differential scanning fluorimetric analysis ChEMBL. 24313754
Delta Tm (binding) = -0.23 degrees C Binding affinity to SP140 bromodomain (unknown origin) assessed as change in melting temperature at 10 uM by differential scanning fluorimetric analysis ChEMBL. 24313754
Delta Tm (binding) = -0.15 degrees C Binding affinity to BAZ2A bromodomain (unknown origin) assessed as change in melting temperature at 10 uM by differential scanning fluorimetric analysis ChEMBL. 24313754
Delta Tm (binding) = -0.13 degrees C Binding affinity to SMARCA4 bromodomain (unknown origin) assessed as change in melting temperature at 10 uM by differential scanning fluorimetric analysis ChEMBL. 24313754
Delta Tm (binding) = -0.07 degrees C Binding affinity to PB1-5 bromodomain (unknown origin) assessed as change in melting temperature at 10 uM by differential scanning fluorimetric analysis ChEMBL. 24313754
Delta Tm (binding) = -0.05 degrees C Binding affinity to PHIP bromodomain-2 (unknown origin) assessed as change in melting temperature at 10 uM by differential scanning fluorimetric analysis ChEMBL. 24313754
Delta Tm (binding) = -0.01 degrees C Binding affinity to BRPF3 bromodomain (unknown origin) assessed as change in melting temperature at 10 uM by differential scanning fluorimetric analysis ChEMBL. 24313754
Delta Tm (binding) = 0.06 degrees C Binding affinity to BAZ2B bromodomain (unknown origin) assessed as change in melting temperature at 10 uM by differential scanning fluorimetric analysis ChEMBL. 24313754
Delta Tm (binding) = 0.11 degrees C Binding affinity to TAF1L bromodomain-2 (unknown origin) assessed as change in melting temperature at 10 uM by differential scanning fluorimetric analysis ChEMBL. 24313754
Delta Tm (binding) = 0.14 degrees C Binding affinity to TIF1alpha bromodomain (unknown origin) assessed as change in melting temperature at 10 uM by differential scanning fluorimetric analysis ChEMBL. 24313754
Delta Tm (binding) = 0.47 degrees C Binding affinity to CECR2 bromodomain (unknown origin) assessed as change in melting temperature at 10 uM by differential scanning fluorimetric analysis ChEMBL. 24313754
Delta Tm (binding) = 0.82 degrees C Binding affinity to ATAD2 bromodomain (unknown origin) assessed as change in melting temperature at 10 uM by differential scanning fluorimetric analysis ChEMBL. 24313754
Delta Tm (binding) = 0.92 degrees C Binding affinity to BRD4 bromodomain-2 (unknown origin) assessed as change in melting temperature at 10 uM by differential scanning fluorimetric analysis ChEMBL. 24313754
Delta Tm (binding) = 1.58 degrees C Binding affinity to CREBBP bromodomain (unknown origin) assessed as change in melting temperature at 10 uM by differential scanning fluorimetric analysis ChEMBL. 24313754
Delta Tm (binding) = 1.92 degrees C Binding affinity to BRD4 bromodomain-1 (unknown origin) assessed as change in melting temperature at 10 uM by differential scanning fluorimetric analysis ChEMBL. 24313754

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.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.