Detailed information for compound 1393662

Basic information

Technical information
  • TDR Targets ID: 1393662
  • Name: 3-[(4-methylsulfanylphenyl)methyl]-1,3-diazas piro[4.6]undecane-2,4-dione
  • MW: 318.434 | Formula: C17H22N2O2S
  • H donors: 1 H acceptors: 2 LogP: 3.29 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: CSc1ccc(cc1)CN1C(=O)NC2(C1=O)CCCCCC2
  • InChi: 1S/C17H22N2O2S/c1-22-14-8-6-13(7-9-14)12-19-15(20)17(18-16(19)21)10-4-2-3-5-11-17/h6-9H,2-5,10-12H2,1H3,(H,18,21)
  • InChiKey: PVFULVZBNYHORU-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 3-[[4-(methylthio)phenyl]methyl]-1,3-diazaspiro[4.6]undecane-2,4-dione
  • 3-[4-(methylthio)benzyl]-1,3-diazaspiro[4.6]undecane-2,4-quinone
  • ZINC03458193
  • MLS000772168
  • SMR000376775
  • T5413887

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens nuclear factor, erythroid 2-like 2 Starlite/ChEMBL No references
Homo sapiens glycoprotein hormones, alpha polypeptide Starlite/ChEMBL No references
Homo sapiens survival of motor neuron 2, centromeric Starlite/ChEMBL No references
Homo sapiens TAR DNA binding protein Starlite/ChEMBL No references
Homo sapiens glucagon-like peptide 1 receptor Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus granulosus survival motor neuron protein 1 Get druggable targets OG5_132873 All targets in OG5_132873
Brugia malayi TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi hypothetical protein Get druggable targets OG5_132873 All targets in OG5_132873
Echinococcus multilocularis tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi RNA recognition motif domain containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_132873 All targets in OG5_132873
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus multilocularis survival motor neuron protein 1 Get druggable targets OG5_132873 All targets in OG5_132873
Echinococcus granulosus tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Loa Loa (eye worm) pigment dispersing factor receptor c glucagon-like peptide 1 receptor 463 aa 388 aa 25.8 %
Toxoplasma gondii intraflagellar transport protein 172, putative glycoprotein hormones, alpha polypeptide 116 aa 94 aa 26.6 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0207 0.0541 0.5
Schistosoma mansoni camp/cgmp cyclic nucleotide phosphodiesterase 0.0207 0.0541 0.0484
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.0207 0.0541 0.6239
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0207 0.0541 0.5
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0207 0.0541 0.5
Loa Loa (eye worm) hypothetical protein 0.2564 0.9237 0.9237
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0207 0.0541 0.5
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0207 0.0541 0.0484
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0207 0.0541 0.5
Loa Loa (eye worm) calcium/calmodulin-stimulated cyclic nucleotide phosphodiesterase 0.2771 1 1
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.0207 0.0541 0.6239
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0207 0.0541 0.5
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0207 0.0541 0.5
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0207 0.0541 0.5
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0207 0.0541 0.5
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0207 0.0541 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0207 0.0541 0.5
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0207 0.0541 0.5
Trichomonas vaginalis cGMP-inhibited 3,5-cyclic phosphodiesterase, putative 0.0207 0.0541 0.5
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0207 0.0541 0.5
Loa Loa (eye worm) RNA binding protein 0.0076 0.006 0.006
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0207 0.0541 0.5
Echinococcus multilocularis high affinity cAMP specific 3',5' cyclic 0.0207 0.0541 0.6239
Trichomonas vaginalis cGMP-inhibited 3,5-cyclic phosphodiesterase, putative 0.0207 0.0541 0.5
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0207 0.0541 0.5
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0207 0.0541 0.5
Plasmodium falciparum phosphodiesterase delta, putative 0.0207 0.0541 0.5
Plasmodium vivax 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0207 0.0541 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0207 0.0541 0.5
Plasmodium vivax phosphodiesterase gamma, putative 0.0207 0.0541 0.5
Giardia lamblia Hypothetical protein 0.0207 0.0541 0.5
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0207 0.0541 0.0484
Trypanosoma brucei 3', 5'-cyclic nucleotide phosphodiesterase, putative 0.0207 0.0541 0.5
Plasmodium falciparum 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0207 0.0541 0.5
Schistosoma mansoni cgmp-dependent 35-cyclic phosphodiesterase 0.0207 0.0541 0.0484
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0207 0.0541 0.5
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.0207 0.0541 0.6239
Echinococcus granulosus high affinity cAMP specific 3'5' cyclic 0.0207 0.0541 0.6239
Echinococcus granulosus survival motor neuron protein 1 0.0286 0.0831 1
Trypanosoma brucei cAMP-specific phosphodiesterase, putative 0.0207 0.0541 0.5
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0207 0.0541 0.0484
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0207 0.0541 0.5
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0207 0.0541 0.5
Trichomonas vaginalis cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative 0.0207 0.0541 0.5
Loa Loa (eye worm) hypothetical protein 0.2564 0.9237 0.9237
Loa Loa (eye worm) hypothetical protein 0.0286 0.0831 0.0831
Loa Loa (eye worm) hypothetical protein 0.2771 1 1
Plasmodium vivax 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0207 0.0541 0.5
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0076 0.006 0.006
Giardia lamblia CAMP-specific 3,5-cyclic phosphodiesterase 4B 0.0207 0.0541 0.5
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0207 0.0541 0.5
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0207 0.0541 0.5
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0207 0.0541 0.5
Schistosoma mansoni camp-specific cyclic nucleotide phosphodiesterase 0.2771 1 1
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0207 0.0541 0.5
Brugia malayi Probable 3',5'-cyclic phosphodiesterase T04D3.3, putative 0.0207 0.0541 0.0541
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0207 0.0541 0.5
Trypanosoma cruzi cyclic nucleotide phosphodiesterase 0.0207 0.0541 0.5
Trichomonas vaginalis cAMP/cGMP cyclic nucleotide phosphodiesterase, putative 0.0207 0.0541 0.5
Loa Loa (eye worm) hypothetical protein 0.2564 0.9237 0.9237
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0207 0.0541 0.5
Trypanosoma brucei cAMP-specific phosphodiesterase 0.0207 0.0541 0.5
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0207 0.0541 0.5
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.0207 0.0541 0.6239
Echinococcus multilocularis survival motor neuron protein 1 0.0286 0.0831 1
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0207 0.0541 0.5
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0207 0.0541 0.5
Brugia malayi 3'5'-cyclic nucleotide phosphodiesterase family protein 0.0207 0.0541 0.0541
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0207 0.0541 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0207 0.0541 0.5
Loa Loa (eye worm) hypothetical protein 0.0207 0.0541 0.0541
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0207 0.0541 0.5
Plasmodium vivax cyclic nucleotide phosphodiesterase, putative 0.0207 0.0541 0.5
Schistosoma mansoni high-affinity cgmp-specific 35-cyclic phosphodiesterase 0.0207 0.0541 0.0484
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0207 0.0541 0.5
Loa Loa (eye worm) hypothetical protein 0.0207 0.0541 0.0541
Trypanosoma cruzi cAMP-specific phosphodiesterase, putative 0.0207 0.0541 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0207 0.0541 0.5
Echinococcus granulosus cAMP and cAMP inhibited cGMP 3'5' cyclic 0.0207 0.0541 0.6239
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0207 0.0541 0.5
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0207 0.0541 0.5
Trypanosoma cruzi cAMP phosphodiesterase A, putative 0.0207 0.0541 0.5
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0207 0.0541 0.5
Schistosoma mansoni high-affinity cgmp-specific 35-cyclic phosphodiesterase 0.0207 0.0541 0.0484
Trichomonas vaginalis calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0207 0.0541 0.5
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0207 0.0541 0.5
Leishmania major cAMP phosphodiesterase A, putative;with=GeneDB:LinJ18_V3.1100 0.0207 0.0541 0.5
Loa Loa (eye worm) TAR-binding protein 0.0076 0.006 0.006
Plasmodium falciparum phosphodiesterase gamma, putative 0.0207 0.0541 0.5
Echinococcus granulosus calcium:calmodulin dependent 3'5' cyclic 0.0207 0.0541 0.6239
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0207 0.0541 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0207 0.0541 0.5
Echinococcus multilocularis dual 3',5' cyclic AMP and GMP phosphodiesterase 0.0207 0.0541 0.6239
Schistosoma mansoni calcium/calmodulin-dependent 35-cyclic nucleotide phosphodiesterase 0.0207 0.0541 0.0484
Schistosoma mansoni high-affinity cgmp-specific 35-cyclic phosphodiesterase 0.0207 0.0541 0.0484
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0207 0.0541 0.5
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0207 0.0541 0.5
Trypanosoma brucei hypothetical protein, conserved 0.0207 0.0541 0.5
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0207 0.0541 0.5
Echinococcus multilocularis calcium:calmodulin dependent 3',5' cyclic 0.0207 0.0541 0.6239
Brugia malayi RNA binding protein 0.0076 0.006 0.006
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0207 0.0541 0.5
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0207 0.0541 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0207 0.0541 0.5
Brugia malayi Probable 3',5'-cyclic phosphodiesterase R153.1, putative 0.0207 0.0541 0.0541
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0207 0.0541 0.5
Trypanosoma cruzi cAMP phosphodiesterase A, putative 0.0207 0.0541 0.5
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative 0.0207 0.0541 0.5
Echinococcus granulosus high affinity cgmp specific 3' 5' cyclic 0.0207 0.0541 0.6239
Trypanosoma cruzi hypothetical protein, conserved 0.0207 0.0541 0.5
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0207 0.0541 0.0484
Plasmodium falciparum cGMP-specific phosphodiesterase 0.0207 0.0541 0.5
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0207 0.0541 0.5
Plasmodium falciparum 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0207 0.0541 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0207 0.0541 0.5
Loa Loa (eye worm) hypothetical protein 0.0207 0.0541 0.0541
Echinococcus granulosus calcium:calmodulin dependent 3'5' cyclic 0.0207 0.0541 0.6239
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0207 0.0541 0.5
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0207 0.0541 0.5
Giardia lamblia hypothetical protein 0.0207 0.0541 0.5
Leishmania major cAMP-specific phosphodiesterase, putative 0.0207 0.0541 0.5
Echinococcus multilocularis calcium:calmodulin dependent 3',5' cyclic 0.0207 0.0541 0.6239
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0207 0.0541 0.5
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0207 0.0541 0.5
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0207 0.0541 0.5
Echinococcus granulosus dual 3'5' cyclic AMP and GMP phosphodiesterase 0.0207 0.0541 0.6239
Trichomonas vaginalis cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative 0.0207 0.0541 0.5
Echinococcus multilocularis cAMP and cAMP inhibited cGMP 3',5' cyclic 0.0207 0.0541 0.6239
Leishmania major hypothetical protein, conserved 0.0207 0.0541 0.5
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0207 0.0541 0.5
Brugia malayi 3'5'-cyclic nucleotide phosphodiesterase family protein 0.0207 0.0541 0.0541
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0207 0.0541 0.5
Brugia malayi Probable 3',5'-cyclic phosphodiesterase C32E12.2, putative 0.0207 0.0541 0.0541
Brugia malayi TAR-binding protein 0.0076 0.006 0.006
Trypanosoma cruzi hypothetical protein, conserved 0.0207 0.0541 0.5
Trypanosoma brucei cAMP phosphodiesterase A, putative 0.0207 0.0541 0.5
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0207 0.0541 0.5
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0207 0.0541 0.5
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0207 0.0541 0.5
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0207 0.0541 0.5
Leishmania major hypothetical protein, conserved 0.0207 0.0541 0.5
Plasmodium falciparum cGMP-specific phosphodiesterase 0.0207 0.0541 0.5
Brugia malayi RNA recognition motif domain containing protein 0.0076 0.006 0.006
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0207 0.0541 0.5
Echinococcus multilocularis high affinity cgmp specific 3' 5' cyclic 0.0207 0.0541 0.6239
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0207 0.0541 0.5
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative 0.0207 0.0541 0.5
Trypanosoma brucei 3', 5'-cyclic nucleotide phosphodiesterase, putative 0.0207 0.0541 0.5
Brugia malayi hypothetical protein 0.0286 0.0831 0.0831
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0207 0.0541 0.5
Trypanosoma brucei cAMP-specific phosphodiesterase 0.0207 0.0541 0.5
Loa Loa (eye worm) PDE1B protein 0.0207 0.0541 0.0541
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0207 0.0541 0.5

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 0.005 um PUBCHEM_BIOASSAY: qHTS Assay for Enhancers of SMN2 Splice Variant Expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 10 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 12.5893 uM PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 18.3564 uM PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] ChEMBL. No reference
Potency (functional) 18.526 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 19.9526 uM PubChem BioAssay. qHTS for Activators of Integrin-Mediated Alleviation for Muscular Dystrophy. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 22.3872 um PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 23.0999 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125] ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))] ChEMBL. No reference
Potency (functional) 84.9214 uM PubChem BioAssay. qHTS Assay to Find Inhibitors of Pin1. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

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

No literature references available for this target.

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