Detailed information for compound 1729377

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 506.597 | Formula: C27H34N6O4
  • H donors: 0 H acceptors: 4 LogP: 2.93 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 2
  • SMILES: COc1ccc(cc1C(=O)N(C)C)c1ccc2c(n1)nc(nc2N1CCOC[C@@H]1C)N1CCOC[C@@H]1C
  • InChi: 1S/C27H34N6O4/c1-17-15-36-12-10-32(17)25-20-7-8-22(19-6-9-23(35-5)21(14-19)26(34)31(3)4)28-24(20)29-27(30-25)33-11-13-37-16-18(33)2/h6-9,14,17-18H,10-13,15-16H2,1-5H3/t17-,18-/m0/s1
  • InChiKey: RCFKHMOMPCIKFL-ROUUACIJSA-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 mechanistic target of rapamycin (serine/threonine kinase) Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Trypanosoma congolense Phosphatidylinositol 3-kinase tor2 Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 Get druggable targets OG5_127212 All targets in OG5_127212
Toxoplasma gondii target of rapamycin (TOR), putative Get druggable targets OG5_127212 All targets in OG5_127212
Echinococcus granulosus FKBP12 rapamycin complex associated protein Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative Get druggable targets OG5_127212 All targets in OG5_127212
Candida albicans similar to N terminal region of S. cerevisiae TOR2 (YKL203C) and TOR1 (YJR066W) putative protein/phosphatidylinositol kinases in Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma japonicum FKBP12-rapamycin complex-associated protein, putative Get druggable targets OG5_127212 All targets in OG5_127212
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania major target of rapamycin (TOR) kinase 2, putative Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania mexicana phosphatidylinositol 3 kinase, putative Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania infantum target of rapamycin (TOR) kinase 1, putative Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania donovani Phosphatidylinositol 3-kinase tor2 Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania donovani Phosphatidylinositol 3-kinase tor1 Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma brucei phosphatidylinositol 4-kinase, putative Get druggable targets OG5_127212 All targets in OG5_127212
Candida albicans similar to internal region of S. cerevisiae TOR2 (YKL203C) and TOR1 (YJR066W) protein/phosphatidylinositol kinases involved in n Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Candida albicans frameshifted from upsteam TOR2 CDS (CaP19.9461) Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma japonicum ko:K07203 FKBP12-rapamycin complex-associated protein, putative Get druggable targets OG5_127212 All targets in OG5_127212
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma japonicum FKBP12-rapamycin complex-associated protein, putative Get druggable targets OG5_127212 All targets in OG5_127212
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania mexicana phosphatidylinositol 3-kinase (tor2)-like protein Get druggable targets OG5_127212 All targets in OG5_127212
Candida albicans frameshifted from upstream TOR2 CDS (CaP19.1905) Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma brucei gambiense phosphatidylinositol 3-kinase tor, putative Get druggable targets OG5_127212 All targets in OG5_127212
Candida albicans similar to N terminal region of S. cerevisiae TOR2 (YKL203C) and TOR1 (YJR066W) putative protein/phosphatidylinositol kinases in Get druggable targets OG5_127212 All targets in OG5_127212
Echinococcus multilocularis FKBP12 rapamycin complex associated protein Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Loa Loa (eye worm) phosphatidylinositol 3 Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania infantum target of rapamycin (TOR) kinase 2, putative Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania braziliensis target of rapamycin (TOR) kinase 2, putative Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma congolense Phosphatidylinositol 3-kinase tor1 Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma brucei gambiense phosphatidylinositol 3 kinase, putative Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania major target of rapamycin (TOR) kinase 1, putative Get druggable targets OG5_127212 All targets in OG5_127212
Candida albicans similar to internal region of S. cerevisiae TOR2 (YKL203C) and TOR1 (YJR066W) protein/phosphatidylinositol kinases involved in n Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Giardia lamblia GTOR Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Neospora caninum Phosphatidylinositol 3-kinase tor2, related Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma japonicum FKBP12-rapamycin complex-associated protein, putative Get druggable targets OG5_127212 All targets in OG5_127212
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi Voltage-gated potassium channel, Shaw-family (KCNC, Kv3-like) alpha-subunit. C. elegans egl-36 ortholog 0.0113 0.9608 0.9581
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.2725 0.2837
Echinococcus multilocularis shaker cognate 0.0113 0.9608 0.9581
Loa Loa (eye worm) hypothetical protein 0.0113 0.9608 0.9608
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0113 0.9608 0.9581
Schistosoma mansoni transient receptor potential cation channel subfamily m member 0.0113 0.9608 0.9581
Brugia malayi Voltage-gated potassium channel, Shaw-family (KCNC, Kv3-like) alpha-subunit 0.0113 0.9608 0.9581
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.0054 0.4036 0.3788
Loa Loa (eye worm) hypothetical protein 0.0113 0.9608 0.9608
Echinococcus granulosus sodium leak channel non selective protein 0.0113 0.9608 0.9581
Loa Loa (eye worm) hypothetical protein 0.0113 0.9608 0.9608
Loa Loa (eye worm) hypothetical protein 0.0113 0.9608 0.9608
Echinococcus granulosus transient receptor potential cation channel 0.0113 0.9608 0.9581
Echinococcus granulosus transient receptor potential cation channel 0.0113 0.9608 0.9581
Brugia malayi cation channel family protein 0.0113 0.9608 0.9581
Brugia malayi Voltage-gated calcium channel, T-type, alpha subunit. C. elegans cca-1 ortholog 0.0113 0.9608 0.9581
Echinococcus multilocularis voltage gated hydrogen channel 1 0.0113 0.9608 0.9581
Trichomonas vaginalis PIKK family atypical protein kinase 0.0032 0.1978 0.2058
Leishmania major hypothetical protein, conserved 0.0113 0.9608 1
Echinococcus multilocularis short transient receptor potential channel 6 0.0113 0.9608 0.9581
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0054 0.4036 0.3788
Echinococcus granulosus cyclic nucleotide gated cation channel alpha 3 0.0113 0.9608 0.9581
Echinococcus multilocularis ryanodine receptor 44f 0.0113 0.9608 0.9581
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0113 0.9608 1
Brugia malayi Voltage-gated calcium channel, L-type, alpha subunit. C. elegans egl-19 ortholog 0.0113 0.9608 0.9581
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0113 0.9608 0.9608
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0113 0.9608 0.9581
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.0054 0.4036 0.363
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0637 0.0663
Echinococcus granulosus voltage gated hydrogen channel 1 0.0113 0.9608 0.9581
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.0113 0.9608 0.9581
Echinococcus granulosus potassium voltage gated channel protein 0.0113 0.9608 0.9581
Toxoplasma gondii hypothetical protein 0.0113 0.9608 1
Echinococcus granulosus transient receptor potential cation channel 0.0113 0.9608 0.9581
Echinococcus granulosus transient receptor potential gamma protein 0.0113 0.9608 0.9581
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative 0.0026 0.1341 0.0784
Trypanosoma brucei FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative 0.0023 0.1046 0.0456
Echinococcus multilocularis potassium voltage gated channel subfamily C 0.0113 0.9608 0.9581
Echinococcus multilocularis hyperpolarization activated cyclic 0.0113 0.9608 0.9581
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0637 0.0663
Echinococcus granulosus potassium voltage gated channel subfamily D 0.0113 0.9608 0.9581
Echinococcus multilocularis voltage dependent calcium channel type d subunit 0.0113 0.9608 0.9581
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0054 0.4036 0.363
Loa Loa (eye worm) calcium channel 0.0113 0.9608 0.9608
Trypanosoma cruzi target of rapamycin kinase 3 0.0043 0.2994 0.2627
Loa Loa (eye worm) hypothetical protein 0.0113 0.9608 0.9608
Trichomonas vaginalis PIKK family atypical protein kinase 0.0032 0.1978 0.2058
Echinococcus granulosus potassium:sodium hyperpolarization activated 0.0113 0.9608 0.9581
Schistosoma mansoni voltage-gated potassium channel 0.0113 0.9608 0.9581
Loa Loa (eye worm) hypothetical protein 0.0113 0.9608 0.9608
Echinococcus granulosus transient receptor potential cation channel 0.0113 0.9608 0.9581
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.0054 0.4036 0.363
Brugia malayi ion channel NompC 0.0113 0.9608 0.9581
Echinococcus multilocularis potassium:sodium hyperpolarization activated 0.0113 0.9608 0.9581
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0113 0.9608 0.9581
Echinococcus granulosus Potassium voltage gated channel protein Shaw 0.0113 0.9608 0.9581
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.1679 0.1748
Schistosoma mansoni transient receptor potential channel 4 0.0113 0.9608 0.9581
Brugia malayi Ryanodine Receptor TM 4-6 family protein 0.0113 0.9608 0.9581
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0113 0.9608 0.9581
Brugia malayi cation channel family protein 0.0113 0.9608 0.9581
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.1683 0.1752
Echinococcus multilocularis sodium leak channel non selective protein 0.0113 0.9608 0.9581
Brugia malayi Voltage-gated potassium channel, Shab-family (KCNB, Kv2-like) alpha-subunit 0.0113 0.9608 0.9581
Echinococcus multilocularis potassium voltage gated channel subfamily KQT 0.0113 0.9608 0.9581
Loa Loa (eye worm) hypothetical protein 0.0113 0.9608 0.9608
Schistosoma mansoni voltage-gated potassium channel 0.0113 0.9608 0.9581
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0113 0.9608 1
Brugia malayi Voltage-gated potassium channel, KCNQ (Kv7-like) alpha-subunit. C. elegans kqt-1 ortholog 0.0113 0.9608 0.9581
Loa Loa (eye worm) phosphatidylinositol 3 0.0018 0.0637 0.0637
Loa Loa (eye worm) hypothetical protein 0.0113 0.9608 0.9608
Trichomonas vaginalis PIKK family atypical protein kinase 0.0054 0.4036 0.42
Brugia malayi Voltage-gated calcium channel, alpha subunit 0.0113 0.9608 0.9581
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0113 0.9608 1
Echinococcus granulosus hyperpolarization activated cyclic 0.0113 0.9608 0.9581
Echinococcus multilocularis transient receptor potential gamma protein 0.0113 0.9608 0.9581
Echinococcus granulosus potassium voltage gated channel subfamily A 0.0113 0.9608 0.9581
Echinococcus granulosus short transient receptor potential channel 6 0.0113 0.9608 0.9581
Loa Loa (eye worm) voltage-dependent calcium channel 0.0113 0.9608 0.9608
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0113 0.9608 0.9581
Loa Loa (eye worm) hypothetical protein 0.0113 0.9608 0.9608
Echinococcus multilocularis two pore calcium channel protein 2 0.0113 0.9608 0.9581
Loa Loa (eye worm) phosphatidylinositol 3 0.0054 0.4036 0.4036
Schistosoma mansoni transient receptor potential cation channel subfamily m member 0.0113 0.9608 0.9581
Schistosoma mansoni voltage-gated potassium channel 0.0113 0.9608 0.9581
Echinococcus granulosus sodium channel protein 0.0113 0.9608 0.9581
Echinococcus granulosus two pore calcium channel protein 1 0.0113 0.9608 0.9581
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.0113 0.9608 0.9581
Brugia malayi Voltage-gated potassium channel, Shaker-family (KCNA, Kv1-like) alpha-subunit 0.0113 0.9608 0.9581
Schistosoma mansoni voltage-gated potassium channel 0.0113 0.9608 0.9581
Schistosoma mansoni voltage-gated potassium channel KCNQ 0.0113 0.9608 0.9581
Loa Loa (eye worm) hypothetical protein 0.0113 0.9608 0.9608
Schistosoma mansoni voltage-gated potassium channel 0.0113 0.9608 0.9581
Echinococcus multilocularis potassium voltage gated channel subfamily D 0.0113 0.9608 0.9581
Brugia malayi Cyclic-nucleotide gated cation channel 0.0113 0.9608 0.9581
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0113 0.9608 0.9581
Brugia malayi Transient-receptor-potential like protein 0.0113 0.9608 0.9581
Loa Loa (eye worm) hypothetical protein 0.0113 0.9608 0.9608
Echinococcus granulosus potassium voltage gated channel protein 0.0113 0.9608 0.9581
Toxoplasma gondii hypothetical protein 0.0113 0.9608 1
Echinococcus granulosus cyclic nucleotide gated cation channel 0.0113 0.9608 0.9581
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.0054 0.4036 0.5
Echinococcus multilocularis potassium voltage gated channel subfamily D 0.0113 0.9608 0.9581
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.2725 0.2837
Echinococcus multilocularis potassium voltage gated channel protein 0.0113 0.9608 0.9581
Schistosoma mansoni voltage-gated potassium channel 0.0113 0.9608 0.9581
Echinococcus multilocularis two pore calcium channel protein 1 0.0113 0.9608 0.9581
Echinococcus multilocularis voltage dependent calcium channel type d subunit 0.0113 0.9608 0.9581
Echinococcus multilocularis cyclic nucleotide gated cation channel 0.0113 0.9608 0.9581
Echinococcus granulosus voltage dependent calcium channel type d subunit|voltage dependent calcium channel|voltage dependent L type calcium channel subu 0.0113 0.9608 0.9581
Schistosoma mansoni 60S ribosomal protein L21 0.0113 0.9608 0.9581
Schistosoma mansoni voltage-gated potassium channel 0.0113 0.9608 0.9581
Loa Loa (eye worm) hypothetical protein 0.0113 0.9608 0.9608
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.1679 0.1748
Brugia malayi Voltage-gated potassium channel, Shab-family (KCNB, Kv2-like) alpha-subunit. C. elegans exp-2 ortholog 0.0113 0.9608 0.9581
Schistosoma mansoni transient receptor potential cation channel subfamily m member 0.0113 0.9608 0.9581
Echinococcus multilocularis transient receptor potential cation channel 0.0113 0.9608 0.9581
Onchocerca volvulus 0.0113 0.9608 0.5
Trichomonas vaginalis PIKK family atypical protein kinase 0.0054 0.4036 0.42
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0637 0.0663
Schistosoma mansoni inositol 145-trisphosphate receptor 0.0113 0.9608 0.9581
Echinococcus granulosus voltage gated potassium channel 0.0113 0.9608 0.9581
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.1683 0.1752
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0113 0.9608 0.9581
Schistosoma mansoni calcium-activated potassium channel 0.0113 0.9608 0.9581
Echinococcus granulosus potassium large conductance calcium activated 0.0113 0.9608 0.9581
Trypanosoma brucei Voltage-dependent calcium channel subunit, putative 0.0113 0.9608 1
Echinococcus multilocularis voltage dependent calcium channel 0.0113 0.9608 0.9581
Schistosoma mansoni voltage-gated potassium channel 0.0113 0.9608 0.9581
Schistosoma mansoni voltage-gated potassium channel 0.0113 0.9608 0.9581
Schistosoma mansoni voltage-gated potassium channel 0.0113 0.9608 0.9581
Trichomonas vaginalis PIKK family atypical protein kinase 0.0032 0.1947 0.2027
Toxoplasma gondii target of rapamycin (TOR), putative 0.004 0.2725 0.2837
Echinococcus granulosus transient receptor potential cation channel 0.0113 0.9608 0.9581
Schistosoma mansoni voltage-gated potassium channel 0.0113 0.9608 0.9581
Loa Loa (eye worm) hypothetical protein 0.0113 0.9608 0.9608
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.1679 0.1748
Loa Loa (eye worm) hypothetical protein 0.0113 0.9608 0.9608
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.2352 0.2448
Schistosoma mansoni voltage-gated potassium channel 0.0113 0.9608 0.9581
Echinococcus multilocularis voltage gated potassium channel 0.0113 0.9608 0.9581
Echinococcus granulosus potassium channel KvQLT family member kqt 1 0.0113 0.9608 0.9581
Schistosoma mansoni voltage-dependent calcium channel 0.0113 0.9608 0.9581
Schistosoma mansoni two-pore calcium channel 0.0113 0.9608 0.9581
Loa Loa (eye worm) hypothetical protein 0.0113 0.9608 0.9608
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.2725 0.2837
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.0054 0.4036 0.3788
Echinococcus granulosus voltage gated potassium channel 0.0113 0.9608 0.9581
Echinococcus multilocularis transfer RNA-Gly 0.0113 0.9608 0.9581
Schistosoma mansoni high voltage-activated calcium channel Cav1 0.0113 0.9608 0.9581
Toxoplasma gondii transporter, cation channel family protein 0.0113 0.9608 1
Echinococcus granulosus shaker cognate 0.0113 0.9608 0.9581
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.2725 0.2837
Loa Loa (eye worm) cyclic-nucleotide gated cation channel 0.0113 0.9608 0.9608
Echinococcus multilocularis transient receptor potential cation channel 0.0113 0.9608 0.9581
Loa Loa (eye worm) hypothetical protein 0.0113 0.9608 0.9608
Giardia lamblia GTOR 0.0054 0.4036 0.5
Echinococcus multilocularis potassium voltage gated channel protein 0.0113 0.9608 0.9581
Schistosoma mansoni transient receptor potential cation channel subfamily m member 0.0113 0.9608 0.9581
Loa Loa (eye worm) cyclic-nucleotide gated cation channel 0.0113 0.9608 0.9608
Loa Loa (eye worm) hypothetical protein 0.0113 0.9608 0.9608
Schistosoma mansoni hypothetical protein 0.0113 0.9608 0.9581
Echinococcus multilocularis voltage dependent L type calcium channel subunit 0.0113 0.9608 0.9581
Loa Loa (eye worm) voltage-gated calcium channel 0.0113 0.9608 0.9608
Echinococcus granulosus potassium voltage gated channel protein 0.0113 0.9608 0.9581
Schistosoma mansoni voltage-gated potassium channel 0.0113 0.9608 0.9581
Echinococcus granulosus potassium voltage gated channel subfamily D 0.0113 0.9608 0.9581
Echinococcus multilocularis transient receptor potential cation channel 0.0113 0.9608 0.9581
Trypanosoma brucei target of rapamycin kinase 3, putative 0.0043 0.2994 0.2627
Loa Loa (eye worm) hypothetical protein 0.0113 0.9608 0.9608
Trypanosoma cruzi Voltage-dependent calcium channel subunit, putative 0.0113 0.9608 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.1683 0.1752
Trichomonas vaginalis PIKK family atypical protein kinase 0.0043 0.2989 0.3111
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.0054 0.4036 0.3788
Loa Loa (eye worm) voltage-gated potassium channel 0.0113 0.9608 0.9608
Loa Loa (eye worm) voltage-gated potassium channel 0.0113 0.9608 0.9608
Leishmania major calcium channel protein, putative,ion transporter, putative 0.0113 0.9608 1
Trypanosoma cruzi inositol 1,4,5-trisphosphate receptor, putative 0.0113 0.9608 1
Echinococcus granulosus voltage dependent calcium channel 0.0113 0.9608 0.9581
Echinococcus granulosus cyclic nucleotide gated cation channel 0.0113 0.9608 0.9581
Toxoplasma gondii transporter, cation channel family protein 0.0113 0.9608 1
Schistosoma mansoni voltage-gated potassium channel 0.0113 0.9608 0.9581
Echinococcus multilocularis sodium channel protein 0.0113 0.9608 0.9581
Echinococcus multilocularis voltage dependent calcium channel 0.0113 0.9608 0.9581
Echinococcus multilocularis cyclic nucleotide gated cation channel alpha 3 0.0113 0.9608 0.9581
Echinococcus granulosus TRP transient receptor potential channel 0.0113 0.9608 0.9581
Trichomonas vaginalis PIKK family atypical protein kinase 0.0054 0.4036 0.42
Trichomonas vaginalis PIKK family atypical protein kinase 0.0035 0.2242 0.2333
Trichomonas vaginalis PIKK family atypical protein kinase 0.0043 0.2989 0.3111
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0113 0.9608 1
Echinococcus granulosus hypothetical protein 0.0113 0.9608 0.9581
Schistosoma mansoni vesicular amine transporter 0.0113 0.9608 0.9581
Echinococcus multilocularis conserved hypothetical protein 0.0113 0.9608 0.9581
Echinococcus granulosus potassium voltage gated channel subfamily C 0.0113 0.9608 0.9581
Echinococcus multilocularis potassium voltage gated channel protein 0.0113 0.9608 0.9581
Brugia malayi Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog 0.0113 0.9608 0.9581
Schistosoma mansoni transient receptor potential cation channel subfamily m member 0.0113 0.9608 0.9581
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.0054 0.4036 0.5
Echinococcus multilocularis voltage gated potassium channel 0.0113 0.9608 0.9581
Schistosoma mansoni voltage-gated cation channel 0.0113 0.9608 0.9581
Echinococcus multilocularis potassium large conductance calcium activated 0.0113 0.9608 0.9581
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.0054 0.4036 0.363
Schistosoma mansoni transient receptor potential channel 0.0113 0.9608 0.9581
Trichomonas vaginalis PIKK family atypical protein kinase 0.0032 0.1978 0.2058
Echinococcus multilocularis potassium voltage gated channel subfamily A 0.0113 0.9608 0.9581
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.1683 0.1752
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0113 0.9608 0.9581
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0637 0.0663
Trichomonas vaginalis PIKK family atypical protein kinase 0.0015 0.0294 0.0306
Schistosoma mansoni voltage-gated potassium channel 0.0113 0.9608 0.9581
Schistosoma mansoni high voltage-activated calcium channel Cav2A 0.0113 0.9608 0.9581
Echinococcus granulosus potassium voltage gated channel protein 0.0113 0.9608 0.9581
Schistosoma mansoni voltage-gated potassium channel 0.0113 0.9608 0.9581
Loa Loa (eye worm) hypothetical protein 0.0113 0.9608 0.9608
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.2725 0.2837
Echinococcus multilocularis potassium voltage gated channel protein 0.0113 0.9608 0.9581
Brugia malayi hypothetical protein 0.0113 0.9608 0.9581
Echinococcus multilocularis potassium voltage gated channel subfamily D 0.0113 0.9608 0.9581
Trichomonas vaginalis PIKK family atypical protein kinase 0.0032 0.1947 0.2027
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.0054 0.4036 0.3788
Echinococcus granulosus potassium voltage gated channel protein 0.0113 0.9608 0.9581
Echinococcus granulosus two pore calcium channel protein 2 0.0113 0.9608 0.9581
Loa Loa (eye worm) ryanodine receptor 0.0113 0.9608 0.9608
Brugia malayi Voltage-gated potassium channel, Shaw-family (KCNC, Kv3-like) alpha-subunit 0.0113 0.9608 0.9581
Echinococcus multilocularis calcium activated potassium channel 0.0113 0.9608 0.9581
Onchocerca volvulus Transient receptor potential cation channel trpm homolog 0.0113 0.9608 0.5
Leishmania major hypothetical protein, unknown function 0.0113 0.9608 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.2725 0.2837
Echinococcus multilocularis TRP (transient receptor potential) channel 0.0113 0.9608 0.9581
Loa Loa (eye worm) hypothetical protein 0.0113 0.9608 0.9608
Loa Loa (eye worm) hypothetical protein 0.0113 0.9608 0.9608
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0113 0.9608 0.9581
Brugia malayi Voltage-gated calcium channel, P/Q-type, alpha subunit. C. elegans unc-2 ortholog 0.0113 0.9608 0.9581
Echinococcus granulosus potassium voltage gated channel subfamily D 0.0113 0.9608 0.9581
Echinococcus granulosus hyperpolarization activated cyclic 0.0113 0.9608 0.9581
Echinococcus granulosus ryanodine receptor 44f 0.0113 0.9608 0.9581
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.0054 0.4036 0.3788
Echinococcus multilocularis transient receptor potential cation channel 0.0113 0.9608 0.9581
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0637 0.0663
Schistosoma mansoni ryanodine receptor related 0.0113 0.9608 0.9581
Brugia malayi voltage-dependent calcium channel 0.0113 0.9608 0.9581
Trichomonas vaginalis PIKK family atypical protein kinase 0.0043 0.2989 0.3111
Echinococcus granulosus voltage dependent L type calcium channel subunit|voltage dependent calcium channel 0.0113 0.9608 0.9581
Schistosoma mansoni calcium channel voltage-dependent p/q type alpha 1a-related 0.0113 0.9608 0.9581
Brugia malayi Large-conductance calcium-activated potassium channel Slo-1 (KCNMA) alpha subunit. C. elegans slo-1 ortholog 0.0113 0.9608 0.9581
Schistosoma mansoni voltage-gated potassium channel 0.0113 0.9608 0.9581
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.2725 0.2837
Schistosoma mansoni transient receptor potential channel 0.0113 0.9608 0.9581
Echinococcus granulosus voltage dependent calcium channel 0.0113 0.9608 0.9581
Echinococcus multilocularis voltage dependent L type calcium channel subunit 0.0113 0.9608 0.9581
Onchocerca volvulus Transient receptor potential cation channel trpm homolog 0.0113 0.9608 0.5
Loa Loa (eye worm) ion channel NompC 0.0113 0.9608 0.9608
Echinococcus multilocularis hyperpolarization activated cyclic 0.0113 0.9608 0.9581
Leishmania major target of rapamycin kinase (TOR) kinase 3 0.0043 0.2994 0.2627
Echinococcus granulosus voltage gated sodium channel Nav1 alpha subunit 0.0113 0.9608 0.9581
Trichomonas vaginalis PIKK family atypical protein kinase 0.0043 0.2989 0.3111
Schistosoma mansoni voltage-gated ion channel 0.0113 0.9608 0.9581
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.0113 0.9608 0.9581
Schistosoma mansoni voltage-gated potassium channel 0.0113 0.9608 0.9581
Trichomonas vaginalis PIKK family atypical protein kinase 0.0043 0.2989 0.3111
Echinococcus granulosus voltage dependent calcium channel type d subunit|voltage dependent calcium channel alpha 1 0.0113 0.9608 0.9581
Trichomonas vaginalis PIKK family atypical protein kinase 0.0046 0.3288 0.3422
Trypanosoma brucei inositol 1,4,5-trisphosphate receptor 0.0113 0.9608 1
Echinococcus granulosus calcium activated potassium channel 0.0113 0.9608 0.9581
Toxoplasma gondii transporter, cation channel family protein 0.0113 0.9608 1

Activities

Activity type Activity value Assay description Source Reference
CLH (ADMET) = 4.3 uL/min Clearance in human hepatocytes assessed per 10'6 cells ChEMBL. 23375793
IC50 (binding) = 42 nM BindingDB_Patents: Alternative Enzyme Assay. The assay used AlphaScreen technology (Gray et al., Analytical Biochemistry, 2003, 313: 234-245) to determine the ability of test compounds to inhibit phosphorylation by recombinant mTOR.Test compounds were prepared as 10 mM stock solutions in DMSO and diluted into water as required to give a range of final assay concentrations. Aliquots (2 ul) of each compound dilution were placed into a well of a Greiner 384-well low volume (LV) white polystyrene plate (Greiner Bio-one). A 10 ul mixture of recombinant purified mTOR enzyme, 1 uM biotinylated peptide substrate (Biotin-Ahx-Lys-Lys-Ala-Asn-Gln-Val-Phe-Leu-Gly-Phe-Thr-Tyr-Val-Ala-Pro-Ser-Val-Leu-Glu-Ser-Val-Lys-Glu-NH2; Bachem UK Ltd), ATP (20 uM) in a buffer solution [comprising Tris-HCl pH7.4 buffer (50 mM), EGTA (0.1 mM), bovine serum albumin (0.5 mg/ml), DTT (1.25 mM) and manganese chloride (10 mM)] were added to the assay plates and incubated with compound for 2 hours at room temperature. ChEMBL. No reference
IC50 (binding) > 32 uM Inhibition of human ERG ChEMBL. 23375793

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.

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