Detailed information for compound 1625768

Basic information

Technical information
  • TDR Targets ID: 1625768
  • Name: 2-[(4R)-5,5-dimethyl-4-phenyl-2-sulfanylidene -1,3-dioxa-2$l^{5}-phosphacyclohex-2-yl]pyrid ine
  • MW: 319.358 | Formula: C16H18NO2PS
  • H donors: 0 H acceptors: 1 LogP: 4.51 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC1(C)COP(=S)(O[C@@H]1c1ccccc1)c1ccccn1
  • InChi: 1S/C16H18NO2PS/c1-16(2)12-18-20(21,14-10-6-7-11-17-14)19-15(16)13-8-4-3-5-9-13/h3-11,15H,12H2,1-2H3/t15-,20?/m1/s1
  • InChiKey: PFWNRRXWRSEWGF-IWPPFLRJSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 2-[(2S,4R)-5,5-dimethyl-4-phenyl-2-sulfanylidene-1,3-dioxa-2$l^{5}-phosphacyclohex-2-yl]pyridine
  • 2-[(4R)-5,5-dimethyl-4-phenyl-2-thioxo-1,3-dioxa-2$l^{5}-phosphacyclohex-2-yl]pyridine
  • 2-[(2S,4R)-5,5-dimethyl-4-phenyl-2-thioxo-1,3-dioxa-2$l^{5}-phosphacyclohex-2-yl]pyridine
  • NCI60_038879
  • NSC710454
  • NSC710456
  • NCI60_038880

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 conserved hypothetical protein 0.0849 0.1243 1
Mycobacterium ulcerans sugar-transport integral membrane protein SugI 0.0849 0.1243 1
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Plasmodium falciparum major facilitator superfamily domain-containing protein, putative 0.0849 0.1243 1
Mycobacterium ulcerans sugar transporter 0.0849 0.1243 1
Echinococcus granulosus protein kinase c iota type 0.0232 0.0298 0.0298
Giardia lamblia Hexose transporter 0.0849 0.1243 1
Trypanosoma cruzi kinetoplastid kinetochore protein 19, putative 0.0122 0.0131 0.1005
Loa Loa (eye worm) hypothetical protein 0.0849 0.1243 0.1243
Mycobacterium ulcerans cytochrome P450 189A7 Cyp189A7 0.0057 0.0031 0.0251
Echinococcus granulosus hypothetical protein 0.012 0.0127 0.0127
Schistosoma mansoni glucose transport protein 0.0849 0.1243 0.1237
Mycobacterium ulcerans cytochrome P450 142A3 Cyp142A3 0.0057 0.0031 0.0251
Schistosoma mansoni sugar transporter 0.0849 0.1243 0.1237
Echinococcus granulosus voltage gated sodium channel Nav1 alpha subunit 0.0074 0.0057 0.0057
Echinococcus granulosus sodium channel protein 0.0074 0.0057 0.0057
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0236 0.0304 0.0315
Trichomonas vaginalis sugar transport protein, putative 0.0849 0.1243 1
Leishmania major cytochrome p450-like protein 0.0085 0.0075 0.0552
Trypanosoma cruzi phosphatidylinositol 3-kinase, putative 0.0119 0.0126 0.0965
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0068 0.0048 0.0143
Echinococcus granulosus cytochrome P450 2K1 0.0057 0.0031 0.0031
Trichomonas vaginalis conserved hypothetical protein 0.0849 0.1243 1
Echinococcus granulosus synaptic vesicle 2 protein 0.0849 0.1243 0.1243
Mycobacterium ulcerans cytochrome P450 124A1, Cyp124A1 0.0057 0.0031 0.0251
Giardia lamblia Phosphoinositide-3-kinase, catalytic, alpha polypeptide 0.0253 0.0331 0.2629
Brugia malayi Protein kinase domain containing protein 0.0122 0.0131 0.0135
Trichomonas vaginalis CMGC family protein kinase 0.0109 0.0111 0.0849
Loa Loa (eye worm) AGC/PKC/IOTA protein kinase 0.0232 0.0298 0.0294
Echinococcus multilocularis myotubularin protein 13 0.0229 0.0295 0.0295
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Schistosoma mansoni hypothetical protein 0.0057 0.0031 0.0025
Brugia malayi Protein kinase domain containing protein 0.0232 0.0298 0.0309
Loa Loa (eye worm) sugar transporter 0.0849 0.1243 0.1243
Brugia malayi RhoGAP domain containing protein 0.0229 0.0295 0.0305
Trypanosoma cruzi cytochrome P450, putative 0.0085 0.0075 0.0552
Toxoplasma gondii sugar transporter ST2 0.0849 0.1243 1
Echinococcus granulosus protein kinase c eta type 0.0229 0.0295 0.0295
Schistosoma mansoni phosphatidylinositol 4-kinase 0.0068 0.0048 0.0042
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0134 0.0149 0.1158
Echinococcus granulosus Protein kinase C brain isozyme 0.0232 0.0298 0.0298
Plasmodium vivax sugar transporter, putative 0.0849 0.1243 1
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.0109 0.0111 0.0849
Loa Loa (eye worm) raf kinase 0.6545 0.9951 1
Echinococcus multilocularis phosphatidylinositol 4 phosphate 3 kinase C2 0.0236 0.0304 0.0304
Trypanosoma brucei protein kinase, putative 0.0109 0.0111 0.0849
Brugia malayi Pleckstrin Homology Domain 0.0229 0.0295 0.0305
Echinococcus multilocularis sodium channel protein 0.0074 0.0057 0.0057
Schistosoma mansoni hypothetical protein 0.0229 0.0295 0.0289
Brugia malayi diacylglycerol kinase 0.0229 0.0295 0.0305
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Echinococcus granulosus Sugar transporter ERD6 protein 0.0849 0.1243 0.1243
Echinococcus granulosus solute carrier family 22 0.0849 0.1243 0.1243
Trypanosoma cruzi hexose transporter, putative 0.0849 0.1243 1
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0421 0.0587 0.4696
Trichomonas vaginalis glucose transporter, putative 0.0849 0.1243 1
Schistosoma mansoni glucose transport protein 0.0849 0.1243 0.1237
Schistosoma mansoni chimerin-related rho-gtpase-activating protein 0.0229 0.0295 0.0289
Loa Loa (eye worm) hypothetical protein 0.0087 0.0076 0.0071
Onchocerca volvulus 0.0849 0.1243 1
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 0.0041 0.0006 0.0006
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Schistosoma mansoni serine/threonine protein kinase 0.0122 0.0131 0.0124
Trichomonas vaginalis myo-inositol transporter, putative 0.0849 0.1243 1
Schistosoma mansoni glucose transporter 0.0849 0.1243 0.1237
Loa Loa (eye worm) hypothetical protein 0.0229 0.0295 0.029
Onchocerca volvulus 0.0849 0.1243 1
Echinococcus multilocularis solute carrier family 22 0.0849 0.1243 0.1243
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Mycobacterium ulcerans cytochrome P450 136A2 Cyp136A2 0.0057 0.0031 0.0251
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Loa Loa (eye worm) CMGC/CLK protein kinase 0.0122 0.0131 0.0125
Brugia malayi major facilitator superfamily protein 0.0849 0.1243 0.1288
Brugia malayi Cytochrome P450 family protein 0.0222 0.0284 0.0294
Schistosoma mansoni serine/threonine protein kinase 0.0089 0.008 0.0074
Trichomonas vaginalis CMGC family protein kinase 0.0109 0.0111 0.0849
Echinococcus granulosus guanine nucleotide exchange factor VAV2 0.0229 0.0295 0.0295
Loa Loa (eye worm) hypothetical protein 0.0229 0.0295 0.029
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Brugia malayi diacylglycerol kinase 0.0229 0.0295 0.0305
Mycobacterium ulcerans cytochrome P450 51B1 Cyp51B1 0.0057 0.0031 0.0251
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0255 0.0334 0.033
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0421 0.0587 0.0608
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Schistosoma mansoni serine/threonine protein kinase 0.6577 1 1
Loa Loa (eye worm) hypothetical protein 0.0849 0.1243 0.1243
Entamoeba histolytica protein kinase domain containing protein 0.0089 0.008 0.127
Trichomonas vaginalis CMGC family protein kinase 0.0122 0.0131 0.1005
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.0109 0.0111 0.0849
Trypanosoma brucei glucose transporter, putative 0.0849 0.1243 1
Leishmania major lanosterol 14-alpha-demethylase, putative 0.0057 0.0031 0.0202
Leishmania major cytochrome p450-like protein 0.0057 0.0031 0.0202
Schistosoma mansoni serine/threonine protein kinase 0.0232 0.0298 0.0292
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Brugia malayi hypothetical protein 0.0166 0.0198 0.0205
Mycobacterium ulcerans cytochrome P450 187A4 Cyp187A4 0.0057 0.0031 0.0251
Loa Loa (eye worm) hypothetical protein 0.0849 0.1243 0.1243
Schistosoma mansoni atypical protein kinase C 0.0232 0.0298 0.0292
Entamoeba histolytica diacylglycerol kinase, putative 0.0229 0.0295 0.4967
Loa Loa (eye worm) hypothetical protein 0.0849 0.1243 0.1243
Brugia malayi protein kinase C3,putative 0.0232 0.0298 0.0309
Brugia malayi Sugar transporter family protein 0.0849 0.1243 0.1288
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0109 0.0111 0.0849
Trypanosoma brucei THT1 - hexose transporter, putative 0.0849 0.1243 1
Trypanosoma brucei glucose transporter, putative 0.0849 0.1243 1
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0319 0.0432 0.3445
Schistosoma mansoni single-minded 0.005 0.002 0.0013
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Brugia malayi hypothetical protein 0.0849 0.1243 0.1288
Loa Loa (eye worm) hypothetical protein 0.0849 0.1243 0.1243
Echinococcus multilocularis Zinc finger, PHD finger 0.0068 0.0048 0.0048
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.0068 0.0048 0.0342
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Schistosoma mansoni microtubule-associated protein tau 0.0761 0.1107 0.1102
Entamoeba histolytica diacylglycerol kinase, putative 0.0229 0.0295 0.4967
Schistosoma mansoni serine/threonine protein kinase 0.0122 0.0131 0.0124
Toxoplasma gondii sugar transporter ST3 0.0849 0.1243 1
Loa Loa (eye worm) hypothetical protein 0.0229 0.0295 0.029
Echinococcus multilocularis serine:threonine protein kinase MRCK beta 0.0232 0.0298 0.0298
Loa Loa (eye worm) hypothetical protein 0.0185 0.0227 0.0222
Echinococcus granulosus phosphatidylinositol 45 bisphosphate 3 kinase 0.0598 0.0859 0.0859
Echinococcus multilocularis microtubule associated protein 2 0.0761 0.1107 0.1107
Leishmania major glucose transporter, lmgt1 0.0849 0.1243 1
Loa Loa (eye worm) phosphatidylinositol 3 0.0119 0.0126 0.012
Schistosoma mansoni cytochrome P450 0.0057 0.0031 0.0025
Echinococcus multilocularis synaptic vesicle 2 protein 0.0849 0.1243 0.1243
Brugia malayi Cytochrome P450 family protein 0.0085 0.0075 0.0077
Loa Loa (eye worm) CYP4Cod1 0.0085 0.0075 0.0069
Giardia lamblia Phosphoinositide-3-kinase, class 3 0.0082 0.0069 0.0504
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0849 0.1243 0.1243
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Onchocerca volvulus 0.0849 0.1243 1
Mycobacterium ulcerans fusion protein of transposase for IS2606 and sialic acid-transport integral membrane protein NanT 0.0849 0.1243 1
Echinococcus multilocularis dual specificity 0.0089 0.008 0.008
Loa Loa (eye worm) hypothetical protein 0.0229 0.0295 0.029
Brugia malayi Major Facilitator Superfamily protein 0.0849 0.1243 0.1288
Onchocerca volvulus 0.0229 0.0295 0.2371
Trypanosoma brucei Lanosterol 14-alpha demethylase 0.0057 0.0031 0.0202
Loa Loa (eye worm) hypothetical protein 0.0849 0.1243 0.1243
Trypanosoma cruzi sugar transporter, putative 0.0849 0.1243 1
Echinococcus multilocularis guanine nucleotide exchange factor VAV2 0.0229 0.0295 0.0295
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Toxoplasma gondii facilitative glucose transporter GT1 0.0849 0.1243 1
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Onchocerca volvulus 0.0849 0.1243 1
Mycobacterium leprae putative cytochrome p450 0.0057 0.0031 0.5
Loa Loa (eye worm) phosphatidylinositol 3 0.0532 0.0758 0.0756
Loa Loa (eye worm) hypothetical protein 0.0229 0.0295 0.029
Loa Loa (eye worm) AGC/PKC/ETA protein kinase 0.0232 0.0298 0.0294
Loa Loa (eye worm) hypothetical protein 0.0849 0.1243 0.1243
Giardia lamblia Sugar-proton symporter 0.0849 0.1243 1
Loa Loa (eye worm) CMGC/DYRK/DYRK1 protein kinase 0.0089 0.008 0.0074
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0849 0.1243 0.1243
Echinococcus granulosus solute carrier family 22 0.0849 0.1243 0.1243
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0134 0.0149 0.1158
Onchocerca volvulus Putative transporter 0.0849 0.1243 1
Echinococcus multilocularis Protein kinase C, brain isozyme 0.0232 0.0298 0.0298
Trichomonas vaginalis CMGC family protein kinase 0.0109 0.0111 0.0849
Echinococcus multilocularis protein kinase c eta type 0.0229 0.0295 0.0295
Loa Loa (eye worm) hypothetical protein 0.0229 0.0295 0.029
Brugia malayi Phorbol esters/diacylglycerol binding domain 0.0232 0.0298 0.0309
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.0109 0.0111 0.0849
Wolbachia endosymbiont of Brugia malayi major facilitator superfamily permease 0.0849 0.1243 0.5
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0421 0.0587 0.4696
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0849 0.1243 0.1243
Echinococcus granulosus Rac GTPase activating protein 1 0.0229 0.0295 0.0295
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0421 0.0587 1
Loa Loa (eye worm) hypothetical protein 0.0229 0.0295 0.029
Toxoplasma gondii cell-cycle-associated protein kinase CLK, putative 0.0122 0.0131 0.082
Brugia malayi RhoGAP domain containing protein 0.0229 0.0295 0.0305
Echinococcus granulosus unc 13 munc13 0.0229 0.0295 0.0295
Echinococcus granulosus myotubularin protein 13 0.0229 0.0295 0.0295
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 0.0041 0.0006 0.0006
Brugia malayi MAP kinase sur-1 0.0109 0.0111 0.0115
Schistosoma mansoni serine/threonine protein kinase 0.0232 0.0298 0.0292
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Trypanosoma brucei glucose transporter 1E 0.0849 0.1243 1
Loa Loa (eye worm) hypothetical protein 0.0849 0.1243 0.1243
Trypanosoma cruzi kinetoplastid kinetochore protein 10, putative 0.0122 0.0131 0.1005
Trypanosoma brucei glucose transporter, putative 0.0849 0.1243 1
Leishmania major glucose transporter, lmgt3 0.0849 0.1243 1
Brugia malayi hypoxia-induced factor 1 0.0153 0.0178 0.0185
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit gamma, putative 0.0421 0.0587 0.4696
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0849 0.1243 0.1243
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0598 0.0859 0.0853
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0068 0.0048 0.0342
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0057 0.0031 0.0202
Echinococcus multilocularis solute carrier family 22 0.0849 0.1243 0.1243
Trichomonas vaginalis glucose transporter, putative 0.0849 0.1243 1
Onchocerca volvulus 0.0849 0.1243 1
Schistosoma mansoni serine/threonine protein kinase 0.0232 0.0298 0.0292
Echinococcus multilocularis raf serine:threonine protein kinase 0.6577 1 1
Loa Loa (eye worm) hypothetical protein 0.0849 0.1243 0.1243
Leishmania major phosphatidylinositol 4-kinase alpha, putative 0.0068 0.0048 0.0342
Echinococcus granulosus protein kinase c epsilon type 0.0232 0.0298 0.0298
Entamoeba histolytica phosphatidylinositol 4-kinase, putative 0.0068 0.0048 0.0727
Entamoeba histolytica hypothetical protein 0.0089 0.008 0.127
Schistosoma mansoni nuclear transcription factor X-box binding 1 (nfx1) 0.0849 0.1243 0.1237
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Echinococcus multilocularis solute carrier family 2, facilitated glucose 0.0849 0.1243 0.1243
Brugia malayi Ras association domain family 1 isoform A 0.0229 0.0295 0.0305
Echinococcus granulosus solute carrier family 22 0.0849 0.1243 0.1243
Trypanosoma cruzi hexose transporter, putative 0.0849 0.1243 1
Toxoplasma gondii diacylglycerol kinase, putative 0.0229 0.0295 0.2175
Echinococcus multilocularis N chimaerin 0.0229 0.0295 0.0295
Brugia malayi follicle stimulating hormone receptor 0.0255 0.0334 0.0347
Plasmodium vivax serine/threonine kinase-1, putative 0.0122 0.0131 0.0687
Loa Loa (eye worm) cytochrome P450 family protein 0.0085 0.0075 0.0069
Onchocerca volvulus 0.0849 0.1243 1
Loa Loa (eye worm) CAMK/PKD protein kinase 0.0232 0.0298 0.0294
Entamoeba histolytica hypothetical protein 0.0229 0.0295 0.4967
Loa Loa (eye worm) RasGEF domain-containing protein 0.0229 0.0295 0.029
Trypanosoma brucei cytochrome P450, putative 0.0085 0.0075 0.0552
Onchocerca volvulus 0.0849 0.1243 1
Echinococcus granulosus dual specificity 0.0089 0.008 0.008
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0068 0.0048 0.0042
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0068 0.0048 0.0143
Trypanosoma cruzi kinetoplastid kinetochore protein 10, putative 0.0122 0.0131 0.1005
Loa Loa (eye worm) phosphatidylinositol 4-kinase type 3 alpha isoform 1 0.0068 0.0048 0.0042
Echinococcus granulosus ubiquitin specific protease 41 0.0041 0.0006 0.0006
Brugia malayi Major Facilitator Superfamily protein 0.0849 0.1243 0.1288
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Trypanosoma brucei THT1 - hexose transporter, putative 0.0849 0.1243 1
Loa Loa (eye worm) hypothetical protein 0.0849 0.1243 0.1243
Mycobacterium ulcerans cytochrome P450 144A4 Cyp144A4 0.0057 0.0031 0.0251
Echinococcus granulosus mitogen activated protein kinase 3 0.0109 0.0111 0.0111
Leishmania major glucose transporter/membrane transporter D2, putative 0.0849 0.1243 1
Mycobacterium ulcerans cytochrome P450 108B4 Cyp108B4 0.0057 0.0031 0.0251
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0849 0.1243 0.1243
Leishmania major cytochrome p450-like protein 0.0057 0.0031 0.0202
Giardia lamblia Kinase, CMGC CLK 0.0122 0.0131 0.1005
Entamoeba histolytica hypothetical protein 0.0355 0.0486 0.8262
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Schistosoma mansoni hypothetical protein 0.0849 0.1243 0.1237
Echinococcus multilocularis 0.0057 0.0031 0.0031
Trypanosoma cruzi CMGC/DYRK protein kinase, putative 0.0089 0.008 0.0597
Leishmania major calcium channel protein, putative,ion transporter, putative 0.0074 0.0057 0.0409
Onchocerca volvulus 0.0849 0.1243 1
Brugia malayi RhoGEF domain containing protein 0.0229 0.0295 0.0305
Mycobacterium ulcerans cytochrome P450 191A3 Cyp191A3 0.0057 0.0031 0.0251
Brugia malayi Major Facilitator Superfamily protein 0.0849 0.1243 0.1288
Loa Loa (eye worm) sugar transporter 0.0849 0.1243 0.1243
Plasmodium falciparum hexose transporter 0.0849 0.1243 1
Trypanosoma brucei glucose transporter, putative 0.0849 0.1243 1
Leishmania major phosphatidylinositol 3-kinase, putative 0.0068 0.0048 0.0342
Brugia malayi C1-like domain containing protein 0.0232 0.0298 0.0309
Schistosoma mansoni sugar transporter 0.0849 0.1243 0.1237
Mycobacterium ulcerans cytochrome P450 140A5 Cyp140A5 0.0057 0.0031 0.0251
Mycobacterium leprae Conserved hypothetical protein 0.0057 0.0031 0.5
Brugia malayi Cytochrome P450 family protein 0.0085 0.0075 0.0077
Loa Loa (eye worm) hypothetical protein 0.0229 0.0295 0.029
Schistosoma mansoni unc-13 (munc13) 0.0229 0.0295 0.0289
Echinococcus multilocularis solute carrier family 22 0.0849 0.1243 0.1243
Echinococcus granulosus phosphatidylinositol 4 kinase alpha 0.0068 0.0048 0.0048
Trichomonas vaginalis CMGC family protein kinase 0.0109 0.0111 0.0849
Mycobacterium ulcerans integral membrane transport protein 0.0849 0.1243 1
Echinococcus granulosus mitogen activated protein kinase 0.0109 0.0111 0.0111
Trichomonas vaginalis conserved hypothetical protein 0.0849 0.1243 1
Mycobacterium ulcerans cytochrome P450 188A3 Cyp188A3 0.0057 0.0031 0.0251
Loa Loa (eye worm) TKL/RAF/RAF protein kinase 0.3729 0.5645 0.5671
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0421 0.0587 0.4696
Loa Loa (eye worm) hypothetical protein 0.0229 0.0295 0.029
Mycobacterium ulcerans cytochrome P450 126A3 Cyp126A3 0.0057 0.0031 0.0251
Echinococcus granulosus Serine/threonine-protein kinase Genghis Khan 0.0232 0.0298 0.0298
Echinococcus multilocularis dual specificity protein kinase clk2 0.0122 0.0131 0.0131
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0134 0.0149 0.2465
Schistosoma mansoni sugar transporter 0.0849 0.1243 0.1237
Onchocerca volvulus 0.0849 0.1243 1
Loa Loa (eye worm) hypoxia-induced factor 1 0.0153 0.0178 0.0173
Echinococcus granulosus microtubule associated protein 2 0.0761 0.1107 0.1107
Echinococcus multilocularis phosphatidylinositol 4,5 bisphosphate 3 kinase 0.0598 0.0859 0.0859
Onchocerca volvulus 0.0849 0.1243 1
Loa Loa (eye worm) hypothetical protein 0.0166 0.0198 0.0193
Onchocerca volvulus 0.0229 0.0295 0.2371
Trypanosoma cruzi CMGC/DYRK protein kinase, putative 0.0089 0.008 0.0597
Loa Loa (eye worm) variant SH3 domain-containing protein 0.0229 0.0295 0.029
Echinococcus multilocularis Sugar transporter ERD6 protein 0.0849 0.1243 0.1243
Trypanosoma cruzi kinetoplastid kinetochore protein 19, putative 0.0122 0.0131 0.1005
Mycobacterium ulcerans cytochrome P450 123A3 Cyp123A3 0.0057 0.0031 0.0251
Trypanosoma cruzi hexose transporter, putative 0.0849 0.1243 1
Plasmodium falciparum protein serine/threonine kinase-1 0.0122 0.0131 0.0687
Schistosoma mansoni rac gtpase activating protein 0.0229 0.0295 0.0289
Trypanosoma brucei phosphatidylinositol 4-kinase alpha, putative 0.0068 0.0048 0.0342
Schistosoma mansoni aryl hydrocarbon receptor 0.005 0.002 0.0013
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0109 0.0111 0.0849
Echinococcus multilocularis Rac GTPase activating protein 1 0.0229 0.0295 0.0295
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Mycobacterium ulcerans cytochrome p450 150 cyp150 0.0057 0.0031 0.0251
Brugia malayi Sugar transporter family protein 0.0849 0.1243 0.1288
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.0421 0.0587 0.4696
Trichomonas vaginalis conserved hypothetical protein 0.0849 0.1243 1
Echinococcus multilocularis C2 calcium dependent membrane targeting 0.0229 0.0295 0.0295
Trypanosoma brucei THT1 - hexose transporter, putative 0.0849 0.1243 1
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0319 0.0432 0.3445
Schistosoma mansoni vav2 0.0229 0.0295 0.0289
Echinococcus granulosus dual specificity protein kinase clk2 0.0122 0.0131 0.0131
Mycobacterium ulcerans cytochrome P450 125A7 Cyp125A7 0.0057 0.0031 0.0251
Echinococcus multilocularis mitogen activated protein kinase 0.0109 0.0111 0.0111
Loa Loa (eye worm) major facilitator superfamily transporter 0.0849 0.1243 0.1243
Loa Loa (eye worm) hypothetical protein 0.0849 0.1243 0.1243
Toxoplasma gondii sugar transporter ST1 0.0849 0.1243 1
Schistosoma mansoni diacylglycerol kinase theta 0.0229 0.0295 0.0289
Trypanosoma cruzi hexose transporter 0.0849 0.1243 1
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0068 0.0048 0.0342
Schistosoma mansoni diacylglycerol kinase theta 0.0229 0.0295 0.0289
Trichomonas vaginalis conserved hypothetical protein 0.0849 0.1243 1
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.0109 0.0111 0.0849
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0134 0.0149 0.0155
Brugia malayi Protein kinase c protein 2 0.0232 0.0298 0.0309
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0849 0.1243 0.1243
Toxoplasma gondii transporter, major facilitator family protein 0.0849 0.1243 1
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Brugia malayi hypothetical protein 0.0849 0.1243 0.1288
Loa Loa (eye worm) hypothetical protein 0.0229 0.0295 0.029
Brugia malayi phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative 0.0178 0.0216 0.0224
Loa Loa (eye worm) cytochrome P450 family protein 0.0222 0.0284 0.0279
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0134 0.0149 0.0143
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Schistosoma mansoni sugar transporter 0.0849 0.1243 0.1237
Entamoeba histolytica phosphatidylinositol 3-kinase 1, putative 0.0405 0.0563 0.9591
Entamoeba histolytica protein kinase, putative 0.0089 0.008 0.127
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.0068 0.0048 0.0342
Leishmania major protein kinase, putative 0.0122 0.0131 0.1005
Echinococcus granulosus phosphatidylinositol 3 kinase catalytic subunit 0.0068 0.0048 0.0048
Leishmania major hypothetical protein, conserved 0.0849 0.1243 1
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0134 0.0149 0.1158
Loa Loa (eye worm) major facilitator superfamily transporter 0.0849 0.1243 0.1243
Echinococcus multilocularis solute carrier family 22 0.0849 0.1243 0.1243
Loa Loa (eye worm) hypothetical protein 0.0229 0.0295 0.029
Trypanosoma brucei kinetoplastid kinetochore protein 10 0.0122 0.0131 0.1005
Trypanosoma cruzi cytochrome p450-like protein, putative 0.0057 0.0031 0.0202
Brugia malayi hypothetical protein 0.0849 0.1243 0.1288
Echinococcus multilocularis Diacylglycerol kinase theta 0.0229 0.0295 0.0295
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0849 0.1243 0.1243
Mycobacterium tuberculosis Probable dicarboxylic acid transport integral membrane protein KgtP (dicarboxylate transporter) 0.0849 0.1243 1
Loa Loa (eye worm) hypothetical protein 0.0087 0.0076 0.0071
Schistosoma mansoni glucose transport protein 0.0849 0.1243 0.1237
Trypanosoma brucei glucose transporter, putative 0.0849 0.1243 1
Echinococcus granulosus N chimaerin 0.0229 0.0295 0.0295
Loa Loa (eye worm) hypothetical protein 0.0849 0.1243 0.1243
Onchocerca volvulus 0.0849 0.1243 1
Loa Loa (eye worm) hypothetical protein 0.0849 0.1243 0.1243
Loa Loa (eye worm) hypothetical protein 0.0229 0.0295 0.029
Trypanosoma brucei kinetoplastid kinetochore protein 19 0.0122 0.0131 0.1005
Loa Loa (eye worm) hypothetical protein 0.0849 0.1243 0.1243
Brugia malayi Cytochrome P450 family protein 0.0057 0.0031 0.0032
Entamoeba histolytica phosphatidylinositol-4,5-bisphosphate 3-kinase, putative 0.0068 0.0048 0.0727
Schistosoma mansoni protein kinase C mu 0.0232 0.0298 0.0292
Schistosoma mansoni protein kinase C 0.0229 0.0295 0.0289
Onchocerca volvulus 0.0849 0.1243 1
Echinococcus granulosus C2 calcium dependent membrane targeting 0.0229 0.0295 0.0295
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0355 0.0486 0.8262
Brugia malayi protein kinase C II. 0.0232 0.0298 0.0309
Loa Loa (eye worm) hypothetical protein 0.012 0.0127 0.0121
Trypanosoma brucei CMGC/DYRK protein kinase, putative 0.0089 0.008 0.0597
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Mycobacterium ulcerans cytochrome P450 105Q4 Cyp105Q4 0.0057 0.0031 0.0251
Schistosoma mansoni serine/threonine protein kinase 0.0232 0.0298 0.0292
Leishmania major myo-inositol/proton symporter (MIT) 0.0849 0.1243 1
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0085 0.0075 0.06
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Mycobacterium tuberculosis Probable conserved integral membrane transport protein 0.0849 0.1243 1
Loa Loa (eye worm) cytochrome P450 0.0057 0.0031 0.0025
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Onchocerca volvulus 0.0849 0.1243 1
Trypanosoma brucei glucose transporter, putative 0.0849 0.1243 1
Echinococcus multilocularis protein kinase c epsilon type 0.0232 0.0298 0.0298
Echinococcus multilocularis unc 13 (munc13) 0.0229 0.0295 0.0295
Schistosoma mansoni unc-13 (munc13) 0.0229 0.0295 0.0289
Echinococcus granulosus Diacylglycerol kinase theta 0.0229 0.0295 0.0295
Trypanosoma brucei glucose transporter, putative 0.0849 0.1243 1
Loa Loa (eye worm) RhoGAP domain-containing protein 0.0229 0.0295 0.029
Schistosoma mansoni protein kinase C mu 0.0229 0.0295 0.0289
Trypanosoma brucei glucose transporter, putative 0.0849 0.1243 1
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Brugia malayi PAS domain containing protein 0.005 0.002 0.002
Trichomonas vaginalis phosphatidylinositol 4-kinase, putative 0.0068 0.0048 0.0342
Onchocerca volvulus 0.0849 0.1243 1
Onchocerca volvulus 0.0849 0.1243 1
Echinococcus multilocularis ubiquitin specific protease 41 0.0041 0.0006 0.0006
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Trichomonas vaginalis conserved hypothetical protein 0.0849 0.1243 1
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.017 0.0203 0.3392
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Leishmania major serine/threonine-protein kinase, putative,protein kinase, putative 0.0089 0.008 0.0597
Loa Loa (eye worm) cytochrome P450 family protein 0.0085 0.0075 0.0069
Loa Loa (eye worm) Ras association domain family 1 isoform A 0.0229 0.0295 0.029
Trypanosoma brucei myo-inositol/proton symporter (MIT) 0.0849 0.1243 1
Trypanosoma cruzi glucose transporter, putative 0.0849 0.1243 1
Trypanosoma brucei glucose transporter 2A 0.0849 0.1243 1
Echinococcus granulosus phosphatidylinositol 4 phosphate 3 kinase C2 0.0236 0.0304 0.0304
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Echinococcus granulosus solute carrier family 22 0.0849 0.1243 0.1243
Trichomonas vaginalis sugar transporter, putative 0.0849 0.1243 1
Schistosoma mansoni chimerin-related rho-gtpase-activating protein 0.0229 0.0295 0.0289
Loa Loa (eye worm) hypothetical protein 0.0236 0.0304 0.0299
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 0.0041 0.0006 0.0006
Trichomonas vaginalis glucose transporter, putative 0.0849 0.1243 1
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.0109 0.0111 0.0106
Leishmania major protein kinase, putative 0.0122 0.0131 0.1005
Echinococcus multilocularis phosphatidylinositol 4 kinase alpha 0.0068 0.0048 0.0048
Onchocerca volvulus 0.0229 0.0295 0.2371
Entamoeba histolytica protein kinase, putative 0.0089 0.008 0.127
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.0109 0.0111 0.0849
Leishmania major glucose transporter, lmgt2 0.0849 0.1243 1
Brugia malayi Sugar transporter family protein 0.0849 0.1243 0.1288
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0134 0.0149 0.1158
Trypanosoma cruzi phosphatidylinositol 3-kinase vps34-like 0.0134 0.0149 0.1158
Loa Loa (eye worm) hypothetical protein 0.0849 0.1243 0.1243
Schistosoma mansoni serine/threonine protein kinase 0.0109 0.0111 0.0105
Mycobacterium ulcerans cytochrome P450 143A4 Cyp143A4 0.0057 0.0031 0.0251
Trypanosoma brucei sugar transporter, putative 0.0849 0.1243 1
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.0109 0.0111 0.0661
Giardia lamblia Kinase, CMGC MAPK 0.0109 0.0111 0.0849
Trichomonas vaginalis conserved hypothetical protein 0.0849 0.1243 1
Mycobacterium ulcerans cytochrome P450 143A3 Cyp143A3 0.0057 0.0031 0.0251
Brugia malayi major facilitator superfamily protein 0.0849 0.1243 0.1288
Brugia malayi phosphatidylinositol 4-kinase, catalytic, alpha polypeptide 0.0068 0.0048 0.005
Echinococcus multilocularis protein kinase c iota type 0.0232 0.0298 0.0298
Brugia malayi Raf kinase 0.6348 0.9649 1
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0041 0.0006 0.0006
Mycobacterium ulcerans cytochrome P450 187A5 Cyp187A5 0.0057 0.0031 0.0251
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0134 0.0149 0.2465
Echinococcus granulosus Solute carrier family 22 5 0.2256 0.3393 0.3393
Echinococcus multilocularis mitogen activated protein kinase 3 0.0109 0.0111 0.0111
Schistosoma mansoni serine/threonine protein kinase 0.0232 0.0298 0.0292
Trypanosoma cruzi cytochrome P450, putative 0.0085 0.0075 0.0552
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0057 0.0031 0.0202
Plasmodium vivax hexose transporter 0.0849 0.1243 1
Mycobacterium ulcerans cytochrome P450 150A6 Cyp150A6 0.0057 0.0031 0.0251
Brugia malayi Variant SH3 domain containing protein 0.0229 0.0295 0.0305
Onchocerca volvulus 0.0849 0.1243 1
Brugia malayi cytochrome P450 0.0057 0.0031 0.0032
Trypanosoma cruzi hexose transporter, putative 0.0849 0.1243 1
Echinococcus multilocularis 0.012 0.0127 0.0127
Brugia malayi Protein kinase domain containing protein 0.0089 0.008 0.0083
Trichomonas vaginalis conserved hypothetical protein 0.0849 0.1243 1
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 0.0041 0.0006 0.0006

Activities

Activity type Activity value Assay description Source Reference
GI50 (functional) -4.618 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HL-60(TB) Leukemia cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.294 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the UO-31 Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.158 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the NCI-H23 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.127 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MDA-N Breast cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SN12C Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the ACHN Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HOP-92 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the DU-145 Prostate cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MALME-3M Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference

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

No literature references available for this target.

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