Detailed information for compound 456543

Basic information

Technical information
  • TDR Targets ID: 456543
  • Name: 1-(3,4-dichlorophenyl)-2-[3-(2-diethylaminoet hyl)-2-iminobenzimidazol-1-yl]ethanol
  • MW: 421.363 | Formula: C21H26Cl2N4O
  • H donors: 1 H acceptors: 1 LogP: 3.89 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCN(CCn1c(=N)n(c2c1cccc2)CC(c1ccc(c(c1)Cl)Cl)O)CC
  • InChi: 1S/C21H26Cl2N4O/c1-3-25(4-2)11-12-26-18-7-5-6-8-19(18)27(21(26)24)14-20(28)15-9-10-16(22)17(23)13-15/h5-10,13,20,24,28H,3-4,11-12,14H2,1-2H3
  • InChiKey: YTILIDHNOSRDBJ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 1-(3,4-dichlorophenyl)-2-[3-(2-diethylaminoethyl)-2-imino-benzimidazol-1-yl]ethanol
  • 1-(3,4-dichlorophenyl)-2-[3-(2-diethylaminoethyl)-2-imino-1-benzimidazolyl]ethanol
  • Oprea1_075996
  • STOCK1S-80339
  • AG-690/13706332
  • BAS 01365359
  • Oprea1_700045

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
Leishmania major lysyl-tRNA synthetase, putative 0.0028 0.0373 0.5041
Loa Loa (eye worm) hypothetical protein 0.0035 0.0511 0.0944
Loa Loa (eye worm) inositol-1 0.0036 0.0519 0.0958
Trichomonas vaginalis lysyl-tRNA synthetase, putative 0.0028 0.0373 0.0421
Mycobacterium leprae Probable pyruvate kinase PykA 0.0032 0.0453 0.6065
Leishmania major prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative 0.0044 0.0676 1
Trypanosoma cruzi sugar transporter, putative 0.0018 0.0175 0.0206
Trypanosoma cruzi hexose transporter 0.0039 0.0581 0.0965
Mycobacterium leprae Possible lysyl-tRNA synthetase 2 LysX 0.0028 0.0373 0.3046
Echinococcus multilocularis conserved hypothetical protein 0.0035 0.0511 0.0679
Echinococcus multilocularis potassium large conductance calcium activated 0.0035 0.0511 0.0679
Toxoplasma gondii calcium-dependent protein kinase CDPK2A 0.0039 0.0572 0.0649
Schistosoma mansoni glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs) 0.0038 0.0557 0.0766
Echinococcus granulosus voltage dependent calcium channel type d subunit|voltage dependent calcium channel alpha 1 0.0294 0.5414 1
Loa Loa (eye worm) major facilitator superfamily transporter 0.0018 0.0175 0.0324
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0036 0.0519 0.0731
Loa Loa (eye worm) hypothetical protein 0.0018 0.0175 0.0324
Echinococcus multilocularis potassium:sodium hyperpolarization activated 0.0035 0.0511 0.0679
Echinococcus multilocularis cyclic nucleotide gated cation channel alpha 3 0.0035 0.0511 0.0679
Echinococcus granulosus inositol monophosphatase 1 0.0036 0.0519 0.0694
Trichomonas vaginalis conserved hypothetical protein 0.0039 0.0581 0.0864
Brugia malayi cation channel family protein 0.0035 0.0511 0.0903
Loa Loa (eye worm) calcium/calmodulin-dependent protein kinase ID 0.0039 0.0572 0.1056
Echinococcus multilocularis pyruvate kinase 0.0026 0.0323 0.0322
Echinococcus multilocularis potassium voltage gated channel subfamily A 0.0035 0.0511 0.0679
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0036 0.0519 0.0848
Loa Loa (eye worm) hypothetical protein 0.0018 0.0175 0.0324
Trypanosoma brucei myo-inositol/proton symporter (MIT) 0.0018 0.0175 0.0206
Echinococcus granulosus transient receptor potential cation channel 0.0035 0.0511 0.0679
Trypanosoma brucei glucose transporter, putative 0.0039 0.0581 0.0965
Schistosoma mansoni high voltage-activated calcium channel Cav1 0.0294 0.5414 1
Plasmodium falciparum calcium-dependent protein kinase 4 0.0039 0.0572 0.0425
Mycobacterium ulcerans sugar transporter 0.0018 0.0175 0.0229
Toxoplasma gondii facilitative glucose transporter GT1 0.0126 0.2233 0.3224
Plasmodium falciparum protein kinase 7 0.0357 0.6603 0.655
Schistosoma mansoni voltage-gated cation channel 0.0294 0.5414 1
Mycobacterium ulcerans sugar-transport integral membrane protein SugI 0.0018 0.0175 0.0229
Echinococcus granulosus cyclic nucleotide gated cation channel alpha 3 0.0035 0.0511 0.0679
Trichomonas vaginalis conserved hypothetical protein 0.0126 0.2233 0.4381
Loa Loa (eye worm) hypothetical protein 0.0018 0.0175 0.0324
Plasmodium falciparum hexose transporter 0.0126 0.2233 0.2111
Echinococcus granulosus potassium voltage gated channel subfamily C 0.0035 0.0511 0.0679
Echinococcus granulosus short transient receptor potential channel 6 0.0035 0.0511 0.0679
Loa Loa (eye worm) hypothetical protein 0.0035 0.0511 0.0944
Echinococcus granulosus voltage dependent calcium channel 0.0294 0.5414 1
Trypanosoma brucei Voltage-dependent calcium channel subunit, putative 0.0294 0.5414 1
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0126 0.2233 0.3952
Schistosoma mansoni voltage-gated potassium channel 0.0035 0.0511 0.0679
Loa Loa (eye worm) hypothetical protein 0.0039 0.0572 0.1056
Brugia malayi Ryanodine Receptor TM 4-6 family protein 0.0035 0.0512 0.0904
Echinococcus granulosus TRP transient receptor potential channel 0.0035 0.0511 0.0679
Plasmodium vivax mitogen-activated protein kinase 2, putative 0.0204 0.3707 0.3609
Echinococcus granulosus Potassium voltage gated channel protein Shaw 0.0035 0.0511 0.0679
Loa Loa (eye worm) hypothetical protein 0.0018 0.0175 0.0324
Schistosoma mansoni two-pore calcium channel 0.0035 0.0511 0.0679
Brugia malayi Voltage-gated calcium channel, P/Q-type, alpha subunit. C. elegans unc-2 ortholog 0.0035 0.0511 0.0903
Schistosoma mansoni voltage-gated potassium channel 0.0035 0.0511 0.0679
Toxoplasma gondii hypothetical protein 0.0258 0.4741 0.7113
Loa Loa (eye worm) pyruvate kinase 0.0032 0.0453 0.0837
Mycobacterium ulcerans fusion protein of transposase for IS2606 and sialic acid-transport integral membrane protein NanT 0.0018 0.0175 0.0229
Loa Loa (eye worm) hypothetical protein 0.0038 0.0557 0.1029
Brugia malayi cation channel family protein 0.0035 0.0511 0.0903
Loa Loa (eye worm) hypothetical protein 0.0035 0.0511 0.0944
Brugia malayi Cytochrome P450 family protein 0.0012 0.0065 0.0075
Schistosoma mansoni sugar transporter 0.0018 0.0175 0.0041
Echinococcus granulosus hypothetical protein 0.0035 0.0511 0.0679
Schistosoma mansoni inositol 145-trisphosphate receptor 0.0035 0.0511 0.0679
Schistosoma mansoni transient receptor potential cation channel subfamily m member 0.0035 0.0511 0.0679
Trypanosoma cruzi prolyl-tRNA synthetase, putative 0.0044 0.0676 0.1142
Echinococcus granulosus potassium large conductance calcium activated 0.0035 0.0511 0.0679
Brugia malayi Major Facilitator Superfamily protein 0.0018 0.0175 0.028
Echinococcus granulosus voltage dependent calcium channel 0.0294 0.5414 1
Trypanosoma brucei glucose transporter, putative 0.0039 0.0581 0.0965
Plasmodium vivax lysine--tRNA ligase, putative 0.0028 0.0373 0.0223
Echinococcus multilocularis potassium voltage gated channel subfamily D 0.0035 0.0511 0.0679
Toxoplasma gondii calcium-dependent protein kinase CDPK2B 0.0039 0.0572 0.0649
Loa Loa (eye worm) hypothetical protein 0.0032 0.0453 0.0837
Schistosoma mansoni transient receptor potential channel 4 0.0035 0.0511 0.0679
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0039 0.0572 0.0794
Loa Loa (eye worm) pyruvate kinase-PB 0.0023 0.0267 0.0493
Schistosoma mansoni high voltage-activated calcium channel Cav2A 0.0294 0.5414 1
Plasmodium vivax pyruvate kinase, putative 0.0032 0.0453 0.0304
Echinococcus granulosus hyperpolarization activated cyclic 0.0035 0.0511 0.0679
Leishmania major protein kinase, putative 0.0039 0.0572 0.8294
Schistosoma mansoni lysyl-tRNA synthetase 0.0028 0.0373 0.0417
Echinococcus multilocularis calcium dependent protein kinase 0.0036 0.0526 0.0708
Echinococcus granulosus solute carrier family 22 0.0018 0.0175 0.0041
Loa Loa (eye worm) pyruvate kinase 0.0032 0.0453 0.0837
Brugia malayi Cytochrome P450 family protein 0.0012 0.0065 0.0075
Echinococcus granulosus potassium voltage gated channel subfamily D 0.0035 0.0511 0.0679
Echinococcus multilocularis voltage gated hydrogen channel 1 0.0035 0.0511 0.0679
Echinococcus granulosus potassium:sodium hyperpolarization activated 0.0035 0.0511 0.0679
Loa Loa (eye worm) hypothetical protein 0.0258 0.4741 0.8758
Loa Loa (eye worm) ion channel NompC 0.0035 0.0511 0.0944
Schistosoma mansoni transient receptor potential cation channel subfamily m member 0.0035 0.0511 0.0679
Toxoplasma gondii transporter, cation channel family protein 0.0035 0.0511 0.0554
Leishmania major myo-inositol/proton symporter (MIT) 0.0018 0.0175 0.1803
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 1 0.0039 0.0572 0.0794
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0039 0.0572 0.0794
Trichomonas vaginalis sugar transporter, putative 0.0039 0.0581 0.0864
Echinococcus multilocularis Sugar transporter ERD6 protein 0.0018 0.0175 0.0041
Brugia malayi glutaminase DH11.1 0.0265 0.4872 0.8995
Plasmodium vivax proline--tRNA ligase, putative 0.0044 0.0676 0.053
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0039 0.0572 0.0794
Trypanosoma brucei glucose transporter, putative 0.0039 0.0581 0.0965
Trypanosoma cruzi hexose transporter, putative 0.0039 0.0581 0.0965
Trypanosoma brucei pyruvate kinase 1 0.0032 0.0453 0.0725
Brugia malayi olfactory channel protein osm-9 0.0035 0.0511 0.0903
Loa Loa (eye worm) sugar transporter 0.0126 0.2233 0.4124
Echinococcus multilocularis voltage dependent calcium channel 0.0294 0.5414 1
Entamoeba histolytica protein kinase, putative 0.0039 0.0572 1
Brugia malayi Pyruvate kinase, muscle isozyme 0.0032 0.0453 0.0795
Schistosoma mansoni voltage-gated potassium channel 0.0035 0.0511 0.0679
Brugia malayi Transient-receptor-potential like protein 0.0035 0.0511 0.0903
Loa Loa (eye worm) hypothetical protein 0.0023 0.0267 0.0493
Echinococcus multilocularis hyperpolarization activated cyclic 0.0035 0.0511 0.0679
Echinococcus multilocularis potassium voltage gated channel protein 0.0035 0.0511 0.0679
Echinococcus multilocularis transient receptor potential cation channel 0.0035 0.0511 0.0679
Schistosoma mansoni voltage-gated potassium channel 0.0035 0.0511 0.0679
Echinococcus multilocularis pyruvate kinase 0.0032 0.0453 0.0568
Schistosoma mansoni ryanodine receptor related 0.0035 0.0512 0.068
Loa Loa (eye worm) pyruvate kinase 0.0032 0.0453 0.0837
Loa Loa (eye worm) hypothetical protein 0.0018 0.0175 0.0324
Echinococcus multilocularis voltage gated potassium channel 0.0035 0.0511 0.0679
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0039 0.0572 0.0794
Trypanosoma brucei glucose transporter 2A 0.0039 0.0581 0.0965
Leishmania major hypothetical protein, unknown function 0.0035 0.0511 0.7302
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0039 0.0572 0.0794
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0126 0.2233 0.3952
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0036 0.0519 0.0566
Echinococcus multilocularis voltage dependent calcium channel type d subunit 0.0294 0.5414 1
Echinococcus granulosus potassium voltage gated channel subfamily D 0.0035 0.0511 0.0679
Brugia malayi Voltage-gated potassium channel, Shaw-family (KCNC, Kv3-like) alpha-subunit 0.0035 0.0511 0.0903
Echinococcus granulosus voltage dependent L type calcium channel subunit|voltage dependent calcium channel 0.0294 0.5414 1
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0035 0.0511 0.0903
Schistosoma mansoni hypothetical protein 0.0035 0.0511 0.0679
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0126 0.2233 0.3952
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0035 0.0511 0.0679
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0126 0.2233 0.3952
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.0035 0.0511 0.0679
Brugia malayi Cam kinase protein 1 0.0039 0.0572 0.1015
Schistosoma mansoni glucose transport protein 0.0126 0.2233 0.3952
Echinococcus multilocularis voltage dependent calcium channel type d subunit 0.0294 0.5414 1
Onchocerca volvulus Pyruvate kinase homolog 0.0032 0.0453 0.8266
Brugia malayi Voltage-gated calcium channel, alpha subunit 0.0035 0.0511 0.0903
Echinococcus multilocularis two pore calcium channel protein 2 0.0035 0.0511 0.0679
Echinococcus granulosus two pore calcium channel protein 2 0.0035 0.0511 0.0679
Schistosoma mansoni transient receptor potential channel 0.0035 0.0511 0.0679
Brugia malayi Sugar transporter family protein 0.0018 0.0175 0.028
Loa Loa (eye worm) hypothetical protein 0.0035 0.0511 0.0944
Plasmodium falciparum calcium-dependent protein kinase 1 0.0039 0.0572 0.0425
Schistosoma mansoni inositol monophosphatase 0.0036 0.0519 0.0694
Giardia lamblia Prolyl-tRNA synthetase 0.0038 0.0557 1
Toxoplasma gondii transporter, major facilitator family protein 0.0018 0.0175 0.0033
Loa Loa (eye worm) voltage-gated calcium channel 0.0035 0.0511 0.0944
Schistosoma mansoni voltage-gated potassium channel 0.0035 0.0511 0.0679
Schistosoma mansoni voltage-gated potassium channel 0.0035 0.0511 0.0679
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0126 0.2233 0.3952
Echinococcus multilocularis calcium activated potassium channel 0.0038 0.0557 0.0766
Echinococcus multilocularis short transient receptor potential channel 6 0.0035 0.0511 0.0679
Treponema pallidum prolyl-tRNA synthetase 0.0013 0.0092 0.5
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0035 0.0511 0.0679
Loa Loa (eye worm) hypothetical protein 0.0018 0.0175 0.0324
Echinococcus granulosus potassium voltage gated channel protein 0.0035 0.0511 0.0679
Brugia malayi Voltage-gated potassium channel, KCNQ (Kv7-like) alpha-subunit. C. elegans kqt-1 ortholog 0.0035 0.0511 0.0903
Mycobacterium tuberculosis Lysyl-tRNA synthetase 1 LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase) 0.0024 0.0293 0.4222
Schistosoma mansoni nuclear transcription factor X-box binding 1 (nfx1) 0.0018 0.0175 0.0041
Brugia malayi Voltage-gated potassium channel, Shaw-family (KCNC, Kv3-like) alpha-subunit 0.0035 0.0511 0.0903
Schistosoma mansoni calcium-activated potassium channel 0.0035 0.0511 0.0679
Loa Loa (eye worm) hypothetical protein 0.0035 0.0511 0.0944
Echinococcus multilocularis potassium voltage gated channel subfamily C 0.0035 0.0511 0.0679
Echinococcus multilocularis short transient receptor potential channel 6 0.0035 0.0511 0.0679
Echinococcus multilocularis General substrate transporter 0.0108 0.1896 0.3312
Loa Loa (eye worm) hypothetical protein 0.0018 0.0175 0.0324
Schistosoma mansoni voltage-gated potassium channel 0.0035 0.0511 0.0679
Loa Loa (eye worm) hypothetical protein 0.0035 0.0511 0.0944
Plasmodium falciparum mitogen-activated protein kinase 2 0.0204 0.3707 0.3609
Schistosoma mansoni transient receptor potential cation channel subfamily m member 0.0035 0.0511 0.0679
Echinococcus granulosus transient receptor potential cation channel 0.0035 0.0511 0.0679
Brugia malayi Calcium/calmodulin-dependent protein kinase type II alpha chain 0.0039 0.0572 0.1015
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0035 0.0511 0.0554
Loa Loa (eye worm) hypothetical protein 0.0018 0.0175 0.0324
Trypanosoma cruzi pyruvate kinase 2, putative 0.0032 0.0453 0.0725
Brugia malayi Cyclic-nucleotide gated cation channel 0.0035 0.0511 0.0903
Trichomonas vaginalis glucose transporter, putative 0.0039 0.0581 0.0864
Plasmodium falciparum proline--tRNA ligase 0.0044 0.0676 0.053
Leishmania major glucose transporter/membrane transporter D2, putative 0.0039 0.0581 0.8448
Echinococcus multilocularis ryanodine receptor 44f 0.0035 0.0512 0.068
Leishmania major glucose transporter, lmgt3 0.0039 0.0581 0.8448
Echinococcus multilocularis transfer RNA-Gly 0.0035 0.0511 0.0679
Schistosoma mansoni voltage-gated potassium channel 0.0035 0.0511 0.0679
Loa Loa (eye worm) cytochrome P450 family protein 0.0012 0.0065 0.012
Brugia malayi lysyl-tRNA synthetase 0.0028 0.0373 0.0647
Echinococcus multilocularis solute carrier family 22 0.0018 0.0175 0.0041
Echinococcus multilocularis sodium channel protein 0.0035 0.0511 0.0679
Echinococcus granulosus potassium voltage gated channel protein 0.0035 0.0511 0.0679
Echinococcus granulosus voltage gated sodium channel Nav1 alpha subunit 0.0035 0.0511 0.0679
Echinococcus granulosus potassium voltage gated channel protein 0.0035 0.0511 0.0679
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0039 0.0572 0.0794
Echinococcus multilocularis solute carrier family 2, facilitated glucose 0.0126 0.2233 0.3952
Entamoeba histolytica hypothetical protein 0.0028 0.0373 0.3479
Schistosoma mansoni transient receptor potential cation channel subfamily m member 0.0035 0.0511 0.0679
Echinococcus granulosus potassium channel KvQLT family member kqt 1 0.0035 0.0511 0.0679
Echinococcus multilocularis shaker cognate 0.0035 0.0511 0.0679
Trypanosoma cruzi Voltage-dependent calcium channel subunit, putative 0.0294 0.5414 1
Loa Loa (eye worm) hypothetical protein 0.0018 0.0175 0.0324
Plasmodium vivax calcium-dependent protein kinase 3, putative 0.0039 0.0572 0.0425
Plasmodium falciparum calcium-dependent protein kinase 3 0.0039 0.0572 0.0425
Plasmodium vivax sugar transporter, putative 0.0018 0.0175 0.0022
Trypanosoma brucei sugar transporter, putative 0.0018 0.0175 0.0206
Echinococcus granulosus voltage gated potassium channel 0.0035 0.0511 0.0679
Echinococcus multilocularis two pore calcium channel protein 1 0.0035 0.0511 0.0679
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0036 0.0519 1
Schistosoma mansoni inositol monophosphatase 0.0036 0.0519 0.0694
Loa Loa (eye worm) voltage-gated potassium channel 0.0035 0.0511 0.0944
Loa Loa (eye worm) bifunctional aminoacyl-tRNA synthetase 0.0016 0.0134 0.0247
Schistosoma mansoni transient receptor potential channel 0.0035 0.0511 0.0679
Trichomonas vaginalis glucose transporter, putative 0.0039 0.0581 0.0864
Trypanosoma brucei THT1 - hexose transporter, putative 0.0039 0.0581 0.0965
Plasmodium falciparum major facilitator superfamily domain-containing protein, putative 0.0018 0.0175 0.0022
Schistosoma mansoni voltage-gated potassium channel 0.0035 0.0511 0.0679
Giardia lamblia Hexose transporter 0.0018 0.0175 0.053
Loa Loa (eye worm) hypothetical protein 0.0035 0.0511 0.0944
Echinococcus multilocularis potassium voltage gated channel subfamily KQT 0.0035 0.0511 0.0679
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0032 0.0447 0.5861
Echinococcus multilocularis transient receptor potential cation channel 0.0035 0.0511 0.0679
Echinococcus multilocularis potassium voltage gated channel subfamily D 0.0035 0.0511 0.0679
Schistosoma mansoni glucose transport protein 0.0126 0.2233 0.3952
Mycobacterium tuberculosis Lysyl-tRNA synthetase 2 LysX 0.0024 0.0293 0.4222
Trypanosoma brucei bifunctional aminoacyl-tRNA synthetase, putative 0.0044 0.0676 0.1142
Schistosoma mansoni transient receptor potential cation channel subfamily m member 0.0035 0.0511 0.0679
Trichomonas vaginalis inositol monophosphatase, putative 0.0036 0.0519 0.0731
Echinococcus granulosus ryanodine receptor 44f 0.0035 0.0512 0.068
Echinococcus granulosus two pore calcium channel protein 1 0.0035 0.0511 0.0679
Echinococcus multilocularis voltage gated potassium channel 0.0035 0.0511 0.0679
Loa Loa (eye worm) hypothetical protein 0.0035 0.0511 0.0944
Trypanosoma brucei glucose transporter 1E 0.0039 0.0581 0.0965
Brugia malayi Bifunctional aminoacyl-tRNA synthetase 0.0038 0.0557 0.0988
Schistosoma mansoni voltage-gated potassium channel 0.0035 0.0511 0.0679
Brugia malayi Sugar transporter family protein 0.0018 0.0175 0.028
Brugia malayi Voltage-gated potassium channel, Shab-family (KCNB, Kv2-like) alpha-subunit. C. elegans exp-2 ortholog 0.0035 0.0511 0.0903
Echinococcus multilocularis pyruvate kinase 0.0032 0.0453 0.0568
Trypanosoma cruzi hexose transporter, putative 0.0018 0.0175 0.0206
Echinococcus granulosus calcium activated potassium channel 0.0038 0.0557 0.0766
Schistosoma mansoni protein kinase 0.0039 0.0572 0.0794
Trypanosoma brucei lysyl-tRNA synthetase, putative 0.0028 0.0373 0.0576
Echinococcus granulosus Sugar transporter ERD6 protein 0.0018 0.0175 0.0041
Echinococcus granulosus shaker cognate 0.0035 0.0511 0.0679
Trypanosoma brucei glucose transporter, putative 0.0039 0.0581 0.0965
Brugia malayi hypothetical protein 0.0018 0.0175 0.028
Brugia malayi Voltage-gated calcium channel, T-type, alpha subunit. C. elegans cca-1 ortholog 0.0035 0.0511 0.0903
Echinococcus granulosus pyruvate kinase 0.0032 0.0453 0.0568
Entamoeba histolytica protein kinase, putative 0.0039 0.0572 1
Echinococcus multilocularis potassium voltage gated channel protein 0.0035 0.0511 0.0679
Chlamydia trachomatis lysine--tRNA ligase 0.0028 0.0373 0.7786
Trichomonas vaginalis lysyl-tRNA synthetase, putative 0.0025 0.0307 0.0281
Trichomonas vaginalis sugar transporter, putative 0.0039 0.0581 0.0864
Echinococcus granulosus glutamyl tRNA synthetase cytoplasmic 0.0038 0.0557 0.0766
Echinococcus granulosus sodium leak channel non selective protein 0.0035 0.0511 0.0679
Trypanosoma brucei inositol 1,4,5-trisphosphate receptor 0.0035 0.0511 0.0834
Echinococcus granulosus potassium voltage gated channel protein 0.0035 0.0511 0.0679
Toxoplasma gondii sugar transporter ST3 0.0018 0.0175 0.0033
Leishmania major glucose transporter, lmgt2 0.0039 0.0581 0.8448
Loa Loa (eye worm) CYP4Cod1 0.0012 0.0065 0.012
Mycobacterium tuberculosis Probable pyruvate kinase PykA 0.0032 0.0453 1
Trypanosoma cruzi inositol 1,4,5-trisphosphate receptor, putative 0.0035 0.0511 0.0834
Onchocerca volvulus Transient receptor potential cation channel trpm homolog 0.0035 0.0511 1
Giardia lamblia Sugar-proton symporter 0.0018 0.0175 0.053
Echinococcus granulosus calcium dependent protein kinase 0.0036 0.0526 0.0708
Loa Loa (eye worm) hypothetical protein 0.0035 0.0511 0.0944
Echinococcus multilocularis solute carrier family 22 0.0018 0.0175 0.0041
Echinococcus granulosus transient receptor potential gamma protein 0.0035 0.0511 0.0679
Leishmania major hypothetical protein, conserved 0.0018 0.0175 0.1803
Schistosoma mansoni glucose transport protein 0.0126 0.2233 0.3952
Schistosoma mansoni sugar transporter 0.0018 0.0175 0.0041
Loa Loa (eye worm) hypothetical protein 0.0018 0.0175 0.0324
Schistosoma mansoni voltage-gated potassium channel 0.0035 0.0511 0.0679
Toxoplasma gondii protein kinase, putative 0.0357 0.6603 1
Plasmodium vivax calcium-dependent protein kinase, putative 0.0039 0.0572 0.0425
Echinococcus granulosus cyclic nucleotide gated cation channel 0.0035 0.0511 0.0679
Schistosoma mansoni 60S ribosomal protein L21 0.0035 0.0511 0.0679
Echinococcus granulosus sodium channel protein 0.0035 0.0511 0.0679
Trichomonas vaginalis sugar transporter, putative 0.0039 0.0581 0.0864
Loa Loa (eye worm) voltage-dependent calcium channel 0.0294 0.5414 1
Mycobacterium ulcerans glutaminase 0.0265 0.4872 1
Schistosoma mansoni voltage-gated potassium channel 0.0035 0.0511 0.0679
Plasmodium falciparum calcium-dependent protein kinase 2 0.0039 0.0572 0.0425
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0035 0.0511 0.0679
Brugia malayi Voltage-gated calcium channel, L-type, alpha subunit. C. elegans egl-19 ortholog 0.0294 0.5414 1
Echinococcus granulosus transient receptor potential cation channel 0.0035 0.0511 0.0679
Brugia malayi hypothetical protein 0.0035 0.0511 0.0903
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0036 0.0519 0.0848
Trichomonas vaginalis glutaminase, putative 0.0265 0.4872 1
Schistosoma mansoni calcium channel voltage-dependent p/q type alpha 1a-related 0.0035 0.0511 0.0679
Trypanosoma cruzi lysyl-tRNA synthetase, putative 0.0028 0.0373 0.0576
Brugia malayi major facilitator superfamily protein 0.0018 0.0175 0.028
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0035 0.0511 0.0944
Trypanosoma cruzi hexose transporter, putative 0.0039 0.0581 0.0965
Mycobacterium ulcerans integral membrane transport protein 0.0018 0.0175 0.0229
Loa Loa (eye worm) hypothetical protein 0.0038 0.0557 0.1029
Brugia malayi Inositol-1 0.0036 0.0519 0.0917
Schistosoma mansoni pyruvate kinase 0.0032 0.0453 0.0568
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.0035 0.0511 0.0679
Plasmodium falciparum lysine--tRNA ligase 0.0028 0.0373 0.0223
Loa Loa (eye worm) hypothetical protein 0.0035 0.0511 0.0944
Trypanosoma brucei pyruvate kinase 1, putative 0.0032 0.0453 0.0725
Leishmania major pyruvate kinase 0.0032 0.0453 0.6348
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0036 0.0519 0.0944
Toxoplasma gondii transporter, cation channel family protein 0.0294 0.5414 0.8156
Chlamydia trachomatis pyruvate kinase 0.0032 0.0453 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0511 0.0944
Echinococcus multilocularis transient receptor potential cation channel 0.0035 0.0511 0.0679
Echinococcus granulosus solute carrier family 22 0.0018 0.0175 0.0041
Trichomonas vaginalis pyruvate kinase, putative 0.0032 0.0453 0.0591
Loa Loa (eye worm) hypothetical protein 0.0035 0.0511 0.0944
Echinococcus granulosus voltage gated potassium channel 0.0035 0.0511 0.0679
Brugia malayi Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog 0.0035 0.0511 0.0903
Schistosoma mansoni vesicular amine transporter 0.0035 0.0511 0.0679
Loa Loa (eye worm) hypothetical protein 0.0258 0.4741 0.8758
Plasmodium falciparum calcium-dependent protein kinase 5 0.0039 0.0572 0.0425
Toxoplasma gondii pyruvate kinase PyK1 0.0032 0.0453 0.0464
Mycobacterium ulcerans lysyl-tRNA synthetase 0.0028 0.0373 0.0641
Echinococcus granulosus hyperpolarization activated cyclic 0.0035 0.0511 0.0679
Brugia malayi hypothetical protein 0.0018 0.0175 0.028
Onchocerca volvulus Pyruvate kinase homolog 0.0032 0.0453 0.8266
Schistosoma mansoni protein kinase 0.0039 0.0572 0.0794
Schistosoma mansoni glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs) 0.0038 0.0557 0.0766
Toxoplasma gondii hypothetical protein 0.0035 0.0511 0.0554
Plasmodium vivax hexose transporter 0.0126 0.2233 0.2111
Entamoeba histolytica prolyl-tRNA synthetase, putative 0.0038 0.0557 0.9513
Trypanosoma cruzi prolyl-tRNA synthetase, putative 0.0044 0.0676 0.1142
Toxoplasma gondii cell-cycle-associated protein kinase MAPK, putative 0.0204 0.3707 0.551
Mycobacterium ulcerans prolyl-tRNA synthetase 0.0013 0.0092 0.0057
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0036 0.0519 0.0731
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0035 0.0511 0.0679
Loa Loa (eye worm) hypothetical protein 0.0294 0.5414 1
Schistosoma mansoni transient receptor potential channel 0.0035 0.0511 0.0679
Onchocerca volvulus Pyruvate kinase homolog 0.0032 0.0453 0.8266
Loa Loa (eye worm) hypothetical protein 0.0035 0.0511 0.0944
Brugia malayi hypothetical protein 0.0018 0.0175 0.028
Brugia malayi Major Facilitator Superfamily protein 0.0018 0.0175 0.028
Trypanosoma brucei glucose transporter, putative 0.0039 0.0581 0.0965
Schistosoma mansoni voltage-gated potassium channel 0.0035 0.0511 0.0679
Echinococcus granulosus solute carrier family 22 0.0018 0.0175 0.0041
Schistosoma mansoni voltage-dependent calcium channel 0.0035 0.0511 0.0679
Loa Loa (eye worm) hypothetical protein 0.0018 0.0175 0.0324
Brugia malayi Voltage-gated potassium channel, Shaw-family (KCNC, Kv3-like) alpha-subunit. C. elegans egl-36 ortholog 0.0035 0.0511 0.0903
Leishmania major glucose transporter, lmgt1 0.0039 0.0581 0.8448
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.0032 0.0447 0.9805
Echinococcus granulosus short transient receptor potential channel 6 0.0035 0.0511 0.0679
Mycobacterium leprae Probable prolyl tRNA synthetase ProS 0.0038 0.0557 1
Brugia malayi voltage-dependent calcium channel 0.0035 0.0511 0.0903
Loa Loa (eye worm) hypothetical protein 0.0035 0.0511 0.0944
Schistosoma mansoni hypothetical protein 0.0126 0.2233 0.3952
Schistosoma mansoni serine/threonine protein kinase 0.0039 0.0572 0.0794
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0126 0.2233 0.3952
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0035 0.0511 0.0679
Echinococcus granulosus voltage dependent calcium channel type d subunit|voltage dependent calcium channel|voltage dependent L type calcium channel subu 0.0294 0.5414 1
Echinococcus granulosus potassium voltage gated channel subfamily D 0.0035 0.0511 0.0679
Schistosoma mansoni voltage-gated ion channel 0.0035 0.0511 0.0679
Schistosoma mansoni protein kinase 0.0039 0.0572 0.0794
Schistosoma mansoni voltage-gated potassium channel 0.0035 0.0511 0.0679
Schistosoma mansoni voltage-gated potassium channel 0.0035 0.0511 0.0679
Loa Loa (eye worm) CAMK/CAMK2 protein kinase 0.0039 0.0572 0.1056
Trypanosoma brucei glucose transporter, putative 0.0039 0.0581 0.0965
Brugia malayi Large-conductance calcium-activated potassium channel Slo-1 (KCNMA) alpha subunit. C. elegans slo-1 ortholog 0.0035 0.0511 0.0903
Leishmania major pyruvate kinase 0.0032 0.0453 0.6348
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0035 0.0511 0.0679
Schistosoma mansoni lysyl-tRNA synthetase 0.0028 0.0373 0.0417
Toxoplasma gondii prolyl-tRNA synthetase (ProRS) 0.0044 0.0676 0.0809
Echinococcus granulosus potassium voltage gated channel protein 0.0035 0.0511 0.0679
Onchocerca volvulus Transient receptor potential cation channel trpm homolog 0.0035 0.0511 1
Echinococcus granulosus cyclic nucleotide gated cation channel 0.0035 0.0511 0.0679
Echinococcus multilocularis voltage dependent L type calcium channel subunit 0.0294 0.5414 1
Echinococcus multilocularis cyclic nucleotide gated cation channel 0.0035 0.0511 0.0679
Toxoplasma gondii lysine-tRNA ligase 0.0028 0.0373 0.034
Echinococcus multilocularis potassium voltage gated channel subfamily D 0.0035 0.0511 0.0679
Schistosoma mansoni pyruvate kinase 0.0032 0.0453 0.0568
Echinococcus granulosus transient receptor potential cation channel 0.0035 0.0511 0.0679
Loa Loa (eye worm) ryanodine receptor 0.0035 0.0511 0.0944
Echinococcus granulosus pyruvate kinase 0.0032 0.0453 0.0568
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0036 0.0519 0.0848
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0036 0.0519 0.7426
Schistosoma mansoni voltage-gated potassium channel KCNQ 0.0035 0.0511 0.0679
Echinococcus multilocularis solute carrier family 22 0.0018 0.0175 0.0041
Echinococcus multilocularis potassium voltage gated channel protein 0.0035 0.0511 0.0679
Brugia malayi Pyruvate kinase, M2 isozyme 0.0032 0.0453 0.0795
Toxoplasma gondii sugar transporter ST2 0.0018 0.0175 0.0033
Echinococcus multilocularis voltage dependent L type calcium channel subunit 0.0294 0.5414 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0511 0.0944
Loa Loa (eye worm) hypothetical protein 0.0018 0.0175 0.0324
Echinococcus multilocularis inositol monophosphatase 1 0.0036 0.0519 0.0694
Echinococcus multilocularis solute carrier family 22 0.0018 0.0175 0.0041
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0035 0.0511 0.0679
Trypanosoma cruzi pyruvate kinase 2, putative 0.0032 0.0453 0.0725
Echinococcus multilocularis voltage dependent calcium channel 0.0294 0.5414 1
Schistosoma mansoni voltage-gated potassium channel 0.0035 0.0511 0.0679
Loa Loa (eye worm) sugar transporter 0.0018 0.0175 0.0324
Loa Loa (eye worm) hypothetical protein 0.0035 0.0511 0.0944
Mycobacterium ulcerans pyruvate kinase 0.0032 0.0453 0.0807
Loa Loa (eye worm) voltage-gated potassium channel 0.0035 0.0511 0.0944
Schistosoma mansoni voltage-gated potassium channel 0.0035 0.0511 0.0679
Loa Loa (eye worm) cyclic-nucleotide gated cation channel 0.0035 0.0511 0.0944
Loa Loa (eye worm) hypothetical protein 0.0031 0.0422 0.078
Loa Loa (eye worm) hypothetical protein 0.0018 0.0175 0.0324
Schistosoma mansoni sugar transporter 0.0018 0.0175 0.0041
Toxoplasma gondii sugar transporter ST1 0.0018 0.0175 0.0033
Trichomonas vaginalis prolyl-tRNA synthetase, putative 0.0038 0.0557 0.0813
Trypanosoma brucei glucose transporter, putative 0.0039 0.0581 0.0965
Schistosoma mansoni voltage-gated potassium channel 0.0035 0.0511 0.0679
Echinococcus multilocularis transient receptor potential cation channel 0.0035 0.0511 0.0679
Loa Loa (eye worm) calcium channel 0.0294 0.5414 1
Trypanosoma cruzi glucose transporter, putative 0.0018 0.0175 0.0206
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0035 0.0511 0.0715
Loa Loa (eye worm) cyclic-nucleotide gated cation channel 0.0035 0.0511 0.0944
Echinococcus granulosus lysyl tRNA synthetase 0.0028 0.0373 0.0417
Schistosoma mansoni glutaminase 0.0265 0.4872 0.897
Loa Loa (eye worm) hypothetical protein 0.0035 0.0511 0.0944
Plasmodium vivax CDK-related protein kinase 6, putative 0.0536 1 1
Loa Loa (eye worm) cytochrome P450 family protein 0.0012 0.0065 0.012
Echinococcus multilocularis sodium leak channel non selective protein 0.0035 0.0511 0.0679
Echinococcus multilocularis synaptic vesicle 2 protein 0.0018 0.0175 0.0041
Loa Loa (eye worm) hypothetical protein 0.0294 0.5414 1
Echinococcus granulosus General substrate transporter 0.0108 0.1896 0.3312
Echinococcus granulosus transient receptor potential cation channel 0.0035 0.0511 0.0679
Mycobacterium ulcerans lysyl-tRNA synthetase 0.0028 0.0373 0.0641
Echinococcus multilocularis lysyl tRNA synthetase 0.0028 0.0373 0.0417
Toxoplasma gondii transporter, cation channel family protein 0.0035 0.0511 0.0554
Trichomonas vaginalis CAMK family protein kinase 0.0039 0.0572 0.0844
Plasmodium vivax calcium-dependent protein kinase 4, putative 0.0039 0.0572 0.0425
Trypanosoma cruzi hexose transporter, putative 0.0039 0.0581 0.0965
Echinococcus granulosus solute carrier family 22 0.0018 0.0175 0.0041
Loa Loa (eye worm) hypothetical protein 0.0018 0.0175 0.0324
Trypanosoma brucei THT1 - hexose transporter, putative 0.0039 0.0581 0.0965
Trypanosoma cruzi hexose transporter, putative 0.0021 0.0245 0.0335
Echinococcus granulosus potassium voltage gated channel subfamily A 0.0035 0.0511 0.0679
Echinococcus multilocularis transient receptor potential cation channel 0.0035 0.0511 0.0679
Loa Loa (eye worm) major facilitator superfamily transporter 0.0018 0.0175 0.0324
Loa Loa (eye worm) hypothetical protein 0.0035 0.0511 0.0944
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0035 0.0511 0.0554
Brugia malayi Sugar transporter family protein 0.0126 0.2233 0.4098
Onchocerca volvulus 0.0035 0.0511 1
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0126 0.2233 0.3952
Echinococcus multilocularis transient receptor potential gamma protein 0.0035 0.0511 0.0679
Leishmania major prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative 0.0044 0.0676 1
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0036 0.0519 0.826
Trichomonas vaginalis pyruvate kinase, putative 0.0032 0.0453 0.0591
Brugia malayi Voltage-gated potassium channel, Shaker-family (KCNA, Kv1-like) alpha-subunit 0.0035 0.0511 0.0903
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0035 0.0511 0.0679
Leishmania major hypothetical protein, conserved 0.0035 0.0511 0.7302
Echinococcus multilocularis hyperpolarization activated cyclic 0.0035 0.0511 0.0679
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.0035 0.0511 0.0679
Echinococcus granulosus voltage gated hydrogen channel 1 0.0035 0.0511 0.0679
Trichomonas vaginalis conserved hypothetical protein 0.0039 0.0581 0.0864
Brugia malayi bifunctional aminoacyl-tRNA synthetase 0.0038 0.0557 0.0988
Schistosoma mansoni glucose transporter 0.0018 0.0175 0.0041
Giardia lamblia Lysyl-tRNA synthetase 0.0028 0.0373 0.5437
Giardia lamblia Pyruvate kinase 0.0032 0.0453 0.7418
Leishmania major calcium channel protein, putative,ion transporter, putative 0.0035 0.0511 0.7302
Loa Loa (eye worm) hypothetical protein 0.0018 0.0175 0.0324
Echinococcus granulosus transient receptor potential cation channel 0.0035 0.0511 0.0679
Brugia malayi Major Facilitator Superfamily protein 0.0018 0.0175 0.028
Plasmodium vivax calcium-dependent protein kinase 1, putative 0.0039 0.0572 0.0425
Echinococcus multilocularis TRP (transient receptor potential) channel 0.0035 0.0511 0.0679
Brugia malayi ion channel NompC 0.0035 0.0511 0.0903
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0035 0.0511 0.0715
Brugia malayi Voltage-gated potassium channel, Shab-family (KCNB, Kv2-like) alpha-subunit 0.0035 0.0511 0.0903
Loa Loa (eye worm) glutaminase 2 0.0265 0.4872 0.8999
Loa Loa (eye worm) hypothetical protein 0.0035 0.0511 0.0944
Toxoplasma gondii calcium-dependent protein kinase CDPK3 0.0039 0.0572 0.0649
Echinococcus multilocularis transient receptor potential cation channel 0.0035 0.0511 0.0679
Plasmodium falciparum pyruvate kinase 0.0032 0.0453 0.0304
Echinococcus granulosus synaptic vesicle 2 protein 0.0018 0.0175 0.0041
Schistosoma mansoni sugar transporter 0.0018 0.0175 0.0041
Brugia malayi major facilitator superfamily protein 0.0018 0.0175 0.028
Loa Loa (eye worm) glutaminase 0.0265 0.4872 0.8999
Echinococcus multilocularis glutamyl tRNA synthetase cytoplasmic 0.0038 0.0557 0.0766
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0039 0.0572 0.0794
Loa Loa (eye worm) hypothetical protein 0.0035 0.0511 0.0944
Trypanosoma brucei glucose transporter, putative 0.0039 0.0581 0.0965
Trypanosoma brucei calcium/calmodulin-dependent protein kinase, putative 0.0039 0.0572 0.0947
Trypanosoma brucei THT1 - hexose transporter, putative 0.0039 0.0581 0.0965
Toxoplasma gondii hypothetical protein 0.0035 0.0511 0.0554
Echinococcus multilocularis potassium voltage gated channel protein 0.0035 0.0511 0.0679
Loa Loa (eye worm) hypothetical protein 0.0028 0.0373 0.0689

Activities

Activity type Activity value Assay description Source Reference
aqueous solubility, where (a) 0 = extremely low, (b) 1 = very low; (c) 2 = low, (d) 3 = good, (e) 4 = optimal, (f) 5 = very soluble (ADMET) = 2 aqueous solubility, where (a) 0 = extremely low, (b) 1 = very low; (c) 2 = low, (d) 3 = good, (e) 4 = optimal, (f) 5 = very soluble Saint Jude. 20485428
Compound predicted to be a mutagen in Ames test: 0=false; 1=true (ADMET) = 0 TRUE if compound predicted to be a mutagen in an Ames test Saint Jude. 20485428
EC50 (functional) = 0.2505 uM Differential activity in the presence of antimalarial artemisinin Saint Jude. 20485428
EC50 (functional) = 0.3326 uM Differential activity in the presence of antimalarial mefloquine Saint Jude. 20485428
EC50 (functional) = 0.3417 uM Differential activity in the presence of antimalarial chloroquine Saint Jude. 20485428
EC50 (functional) = 0.4804 uM Cytotoxic activity for compound versus Plasmodium falciparum Dd2 Saint Jude. 20485428
EC50 (functional) = 0.5632 uM Differential activity in the presence of antimalarial atovaquone Saint Jude. 20485428
EC50 (functional) = 0.72 uM Cytotoxic activity for compound versus Plasmodium falciparum W2 Saint Jude. 20485428
EC50 (functional) = 0.76 uM Plasmodium falciparum K1 EC50 (uM) as measured by SYBR green dye Saint Jude. 20485428
EC50 (functional) = 0.8039 uM Cytotoxic activity for compound versus Plasmodium falciparum 3D7 Saint Jude. 20485428
EC50 (functional) = 0.84 uM Cytotoxic activity for compound versus Plasmodium falciparum D10 transfected with yeast DHOD Saint Jude. 20485428
EC50 (functional) = 0.91 uM Plasmodium falciparum 3D7 EC50 (uM) as measured by SYBR green dye Saint Jude. 20485428
EC50 (functional) = 1.0262 uM Cytotoxic activity for compound versus Plasmodium falciparum K1 Saint Jude. 20485428
EC50 (functional) = 1.0699 uM Cytotoxic activity for compound versus Plasmodium falciparum SB-A6 Saint Jude. 20485428
EC50 (functional) = 1.11 uM Cytotoxic activity for compound versus Plasmodium falciparum V1/S Saint Jude. 20485428
EC50 (functional) = 4.9646 uM Cytotoxic activity for compound versus Trypanosoma brucei Saint Jude. 20485428
EC50 (functional) = 4.9646 uM Cytotoxic activity for compound versus Leishmania major Saint Jude. 20485428
EC50 (functional) = 7.1754 uM Cytotoxic activity for compound versus human epithelial hepatocellular carcinoma cells Saint Jude. 20485428
EC50 (functional) = 9.011 uM Cytotoxic activity for compound versus Toxoplasma gondii Saint Jude. 20485428
EC50 (binding) > 10 uM Plasmodium falciparum dihydroorotate dehydrogenase inhibition assay Saint Jude. 20485428
EC50 (functional) = 23 uM hemozoin polymerization inhibition assay. EC50 from hemozoin assay were approximately derived based on 3 point dose response Saint Jude. 20485428
EC50 (functional) = 30.6649 uM Cytotoxic activity for compound versus human epithelial embryonic kidney cells Saint Jude. 20485428
EC50 (functional) > 43.0992 uM Cytotoxic activity for compound versus human forskin fibroblast cells Saint Jude. 20485428
EC50 (functional) > 43.0992 uM Cytotoxic activity for compound versus human Burkitt's lymphoma lymphoblast cells Saint Jude. 20485428
EC50 (binding) > 50 uM Plasmodium falciparum falcipain 2 inhibition assay Saint Jude. 20485428
IC50 (binding) = 9 uM Inhibition of Trypanosoma brucei rhodesiense trypanothione reductase ChEMBL. 17194585
LD50 (ADMET) = 0.61 g kg-1 rat oral acute median lethal dose (g/kg) Saint Jude. 20485428
passive intestinal absorption level, where (a) 0 good; (b) 1 = moderate; (c) 2 = poor, (d) 3 = very poor (ADMET) = 0 passive intestinal absorption level, where (a) 0 good; (b) 1 = moderate; (c) 2 = poor, (d) 3 = very poor Saint Jude. 20485428
Percent growth inhibition (functional) = 100.5 % Plasmodium falciparum 3D7 % growth inhibition at 7uM as measured by SYBR green dye Saint Jude. 20485428
Percent growth inhibition (functional) = 104.4 % Plasmodium falciparum 3D7 % growth inhibition at 7uM as measured by YOYO-3 red dye Saint Jude. 20485428

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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