Detailed information for compound 326002

Basic information

Technical information
  • TDR Targets ID: 326002
  • Name: 8-[butyl(ethyl)amino]-4-(2-chloro-4-methoxyph enyl)-6-methyl-1,3-dihydropyrido[2,3-b]pyrazi n-2-one; 2,2,2-trifluoroacetic acid
  • MW: 516.941 | Formula: C23H28ClF3N4O4
  • H donors: 2 H acceptors: 4 LogP: 5.49 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 2
  • SMILES: OC(=O)C(F)(F)F.CCCCN(c1cc(C)nc2c1NC(=O)CN2c1ccc(cc1Cl)OC)CC
  • InChi: 1S/C21H27ClN4O2.C2HF3O2/c1-5-7-10-25(6-2)18-11-14(3)23-21-20(18)24-19(27)13-26(21)17-9-8-15(28-4)12-16(17)22;3-2(4,5)1(6)7/h8-9,11-12H,5-7,10,13H2,1-4H3,(H,24,27);(H,6,7)
  • InChiKey: IPLJODHOBMJVDD-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 8-[butyl(ethyl)amino]-4-(2-chloro-4-methoxy-phenyl)-6-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one; 2,2,2-trifluoroacetic acid
  • 8-[butyl(ethyl)amino]-4-(2-chloro-4-methoxy-phenyl)-6-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one; 2,2,2-trifluoroethanoic acid
  • 8-(butyl-ethylamino)-4-(2-chloro-4-methoxyphenyl)-6-methyl-1,3-dihydropyrido[2,3-e]pyrazin-2-one; 2,2,2-trifluoroacetic acid
  • 8-(butyl-ethyl-amino)-4-(2-chloro-4-methoxy-phenyl)-6-methyl-1,3-dihydropyrido[2,3-e]pyrazin-2-one; 2,2,2-trifluoroacetic acid
  • 8-(butyl-ethyl-amino)-4-(2-chloro-4-methoxy-phenyl)-6-methyl-1,3-dihydropyrido[2,3-e]pyrazin-2-one; 2,2,2-trifluoroethanoic acid

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Rattus norvegicus Corticotropin releasing factor receptor 1 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 Get druggable targets OG5_130760 All targets in OG5_130760
Schistosoma japonicum IPR001879,Hormone receptor, extracellular,domain-containing Get druggable targets OG5_130760 All targets in OG5_130760
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_130760 All targets in OG5_130760
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative Get druggable targets OG5_130760 All targets in OG5_130760
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 Get druggable targets OG5_130760 All targets in OG5_130760
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Loa Loa (eye worm) pigment dispersing factor receptor c Corticotropin releasing factor receptor 1   415 aa 394 aa 27.7 %
Onchocerca volvulus Corticotropin releasing factor receptor 1   415 aa 401 aa 30.2 %
Loa Loa (eye worm) hypothetical protein Corticotropin releasing factor receptor 1   415 aa 359 aa 21.4 %
Onchocerca volvulus Pseudouridine-5 prime-monophosphatase homolog Corticotropin releasing factor receptor 1   415 aa 401 aa 27.2 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) serotonin transporter b 0.1986 0.6512 0.6512
Plasmodium falciparum thioredoxin reductase 0.0051 0.0136 0.1036
Loa Loa (eye worm) RGC/RGC protein kinase 0.0071 0.0203 0.0203
Brugia malayi cytochrome P450 0.0011 0.0007 0.0003
Loa Loa (eye worm) hypothetical protein 0.0019 0.0032 0.0032
Giardia lamblia Pyrophosphate-fructose 6-phosphate 1-phosphotransferase alpha subunit 0.0031 0.0073 1
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0018 0.0027 0.002
Trichomonas vaginalis glucosylceramidase, putative 0.018 0.0562 0.6326
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0337 0.108 1
Plasmodium vivax amine transporter, putative 0.0337 0.108 1
Chlamydia trachomatis glutamine binding protein 0.0354 0.1137 1
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.0274 0.0873 0.0869
Loa Loa (eye worm) hypothetical protein 0.0337 0.108 0.108
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0018 0.0027 0.0035
Brugia malayi follicle stimulating hormone receptor 0.0256 0.0812 0.0809
Chlamydia trachomatis arginine ABC transporter substrate-binding protein ArtJ 0.0354 0.1137 1
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0039 0.0098 0.0095
Onchocerca volvulus 0.0255 0.0808 0.1146
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0117 0.0353 0.0503
Loa Loa (eye worm) RGC/RGC protein kinase 0.0071 0.0203 0.0203
Schistosoma mansoni hypothetical protein 0.0434 0.14 0.2142
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.0031 0.0073 0.0435
Trypanosoma cruzi extracellular receptor, putative 0.0071 0.0203 0.0196
Trypanosoma cruzi C-8 sterol isomerase, putative 0.3045 1 1
Loa Loa (eye worm) hypothetical protein 0.0034 0.0081 0.0081
Trichomonas vaginalis ap endonuclease, putative 0.002 0.0035 0.0101
Echinococcus granulosus metabotropic glutamate receptor 5 0.0071 0.0203 0.0305
Mycobacterium tuberculosis Probable glutamine-binding lipoprotein GlnH (GLNBP) 0.0354 0.1137 1
Trypanosoma brucei cytochrome P450, putative 0.0021 0.0037 0.0031
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0033 0.0077 0.0653
Echinococcus multilocularis voltage gated potassium channel 0.0011 0.0006 0.0004
Trypanosoma cruzi trypanothione reductase, putative 0.0018 0.0027 0.002
Brugia malayi Glutamate receptor 1 precursor 0.0138 0.0425 0.0421
Loa Loa (eye worm) hypothetical protein 0.0337 0.108 0.108
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0021 0.0037 0.0274
Echinococcus multilocularis sodium and chloride dependent glycine 0.0337 0.108 0.1653
Trichomonas vaginalis glucosylceramidase, putative 0.018 0.0562 0.6326
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0337 0.108 0.1077
Echinococcus multilocularis glutamate receptor subunit protein glur 0.0138 0.0425 0.0646
Loa Loa (eye worm) glutamate receptor 2 0.0138 0.0425 0.0425
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.0167 0.0164
Brugia malayi 6-phosphofructokinase 0.0117 0.0353 0.0349
Onchocerca volvulus 0.0337 0.108 0.1568
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0209 0.0658 0.1005
Brugia malayi exodeoxyribonuclease III family protein 0.002 0.0035 0.0032
Brugia malayi metabotropic GABA-B receptor subtype 2 0.0071 0.0203 0.0199
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0011 0.0006 0.0004
Loa Loa (eye worm) thioredoxin reductase 0.0051 0.0136 0.0136
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0337 0.108 1
Trichomonas vaginalis phosphofructokinase, putative 0.0117 0.0353 0.3855
Loa Loa (eye worm) cytochrome P450 family protein 0.0021 0.0037 0.0037
Loa Loa (eye worm) hypothetical protein 0.0245 0.0777 0.0777
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.002 0.0035 0.0029
Loa Loa (eye worm) hypothetical protein 0.0071 0.0203 0.0203
Echinococcus multilocularis Ribosomal protein S1, RNA binding domain 0.0138 0.0425 0.0646
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.002 0.0035 1
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0337 0.108 0.1077
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0337 0.108 0.165
Echinococcus granulosus Ribosomal protein S1 RNA binding domain 0.0138 0.0425 0.0646
Loa Loa (eye worm) RGC/RGC protein kinase 0.0071 0.0203 0.0203
Trichomonas vaginalis set domain proteins, putative 0.0255 0.0808 0.9233
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0033 0.0077 0.0112
Plasmodium vivax SET domain protein, putative 0.0033 0.0077 0.0473
Mycobacterium tuberculosis Probable reductase 0.0116 0.035 0.3039
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0337 0.108 0.165
Onchocerca volvulus Atrial natriuretic peptide receptor 3 homolog 0.0071 0.0203 0.0206
Schistosoma mansoni metabotropic glutamate receptor 0.0071 0.0203 0.0301
Echinococcus granulosus serotonin transporter 0.1986 0.6512 1
Schistosoma mansoni glutamate receptor NMDA 0.0209 0.0658 0.1002
Trypanosoma brucei C-8 sterol isomerase, putative 0.3045 1 1
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.002 0.0035 0.0035
Brugia malayi Metabotropic glutamate receptor precursor. 0.0071 0.0203 0.0199
Brugia malayi Receptor family ligand binding region containing protein 0.0071 0.0203 0.0199
Loa Loa (eye worm) cytochrome P450 family protein 0.0032 0.0074 0.0074
Leishmania major acetoin dehydrogenase e3 component-like protein 0.0018 0.0027 0.002
Echinococcus multilocularis glutamate receptor ionotropic kainate 0.0138 0.0425 0.0646
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0033 0.0077 0.0108
Echinococcus granulosus glutamate receptor ionotropic kainate 3 0.0138 0.0425 0.0646
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0039 0.0098 0.0145
Echinococcus granulosus sodium:chloride dependent neurotransmitter 0.0337 0.108 0.1653
Onchocerca volvulus 0.0071 0.0203 0.0206
Loa Loa (eye worm) hypothetical protein 0.0071 0.0203 0.0203
Schistosoma mansoni cpg binding protein 0.0031 0.007 0.0097
Leishmania major trypanothione reductase 0.0051 0.0136 0.013
Brugia malayi hypothetical protein 0.0071 0.0203 0.0199
Echinococcus granulosus sodium and chloride dependent glycine 0.0337 0.108 0.1653
Echinococcus multilocularis GPCR, family 2 0.0019 0.0032 0.0043
Brugia malayi Guanylyl cyclase protein 23 0.0071 0.0203 0.0199
Echinococcus granulosus glutamate receptor ionotrophic AMPA 3 0.0209 0.0658 0.1005
Echinococcus granulosus tyrosine kinase 0.0071 0.0203 0.0305
Loa Loa (eye worm) cytochrome P450 family protein 0.0021 0.0037 0.0037
Echinococcus multilocularis sodium and chloride dependent glycine 0.0337 0.108 0.1653
Brugia malayi Cytochrome P450 family protein 0.0011 0.0007 0.0003
Trichomonas vaginalis glucosylceramidase, putative 0.0274 0.0873 1
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.1986 0.6512 1
Echinococcus granulosus nmda type glutamate receptor 0.0071 0.0203 0.0305
Echinococcus multilocularis nmda type glutamate receptor 0.0071 0.0203 0.0305
Onchocerca volvulus 0.0071 0.0203 0.0206
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0019 0.0032 0.0043
Leishmania major cytochrome p450-like protein 0.0021 0.0037 0.0031
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0209 0.0658 0.1005
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0204 0.0642 0.098
Loa Loa (eye worm) hypothetical protein 0.1556 0.5096 0.5096
Schistosoma mansoni hypothetical protein 0.0019 0.0032 0.0039
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0019 0.0032 0.0043
Loa Loa (eye worm) hypothetical protein 0.0041 0.0105 0.0105
Schistosoma mansoni ATP-binding cassette transporter 0.0138 0.0425 0.0643
Brugia malayi hypothetical protein 0.0131 0.0399 0.0395
Mycobacterium tuberculosis Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot 0.0018 0.0027 0.018
Schistosoma mansoni sodium-dependent amino acid transporter 0.0337 0.108 0.165
Toxoplasma gondii phosphofructokinase domain-containing protein 0.0031 0.0073 0.0617
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0018 0.0027 0.002
Echinococcus granulosus sodium and chloride dependent glycine 0.0337 0.108 0.1653
Loa Loa (eye worm) phosphofructokinase 0.0117 0.0353 0.0353
Trichomonas vaginalis glucosylceramidase, putative 0.018 0.0562 0.6326
Trichomonas vaginalis phosphofructokinase, putative 0.0117 0.0353 0.3855
Echinococcus granulosus voltage gated potassium channel 0.0011 0.0006 0.0004
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0018 0.0027 0.0023
Schistosoma mansoni ap endonuclease 0.002 0.0035 0.0045
Echinococcus granulosus 6 phosphofructokinase 0.0117 0.0353 0.0536
Trypanosoma brucei trypanothione reductase 0.0051 0.0136 0.013
Echinococcus granulosus dnaJ subfamily B 0.0434 0.14 0.2145
Loa Loa (eye worm) glutathione reductase 0.0051 0.0136 0.0136
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0116 0.035 0.8899
Echinococcus granulosus receptor type guanylyl cyclase 0.0071 0.0203 0.0305
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0224 0.0706 0.0706
Treponema pallidum exodeoxyribonuclease (exoA) 0.002 0.0035 0.0013
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0018 0.0027 0.002
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 3 0.0493 0.1592 0.244
Mycobacterium tuberculosis Probable dehydrogenase 0.0116 0.035 0.3039
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0129 0.0393 0.3415
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0033 0.0077 0.0108
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0037 0.009 0.0741
Echinococcus granulosus glutamate receptor 2 0.0071 0.0203 0.0305
Echinococcus multilocularis glutamate (NMDA) receptor subunit 0.0138 0.0425 0.0646
Echinococcus granulosus cytochrome P450 2K1 0.0011 0.0007 0.0004
Loa Loa (eye worm) hypothetical protein 0.0337 0.108 0.108
Treponema pallidum amino acid ABC transporter, periplasmic binding protein (hisJ) 0.0354 0.1137 0.1711
Schistosoma mansoni sodium/chloride dependent transporter 0.1986 0.6512 1
Echinococcus granulosus glutamate receptor 2 0.0209 0.0658 0.1005
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0116 0.035 0.3039
Echinococcus granulosus glutamate receptor ionotropic kainate 0.0138 0.0425 0.0646
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0337 0.108 0.165
Loa Loa (eye worm) CYP4Cod1 0.0021 0.0037 0.0037
Trichomonas vaginalis ap endonuclease, putative 0.002 0.0035 0.0101
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0256 0.0812 0.0812
Loa Loa (eye worm) hypothetical protein 0.0337 0.108 0.108
Loa Loa (eye worm) solute carrier family 6 member 4 0.1986 0.6512 0.6512
Echinococcus granulosus atrial natriuretic peptide receptor 0.0071 0.0203 0.0305
Trichomonas vaginalis phosphofructokinase, putative 0.0031 0.0073 0.0542
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0018 0.0027 0.002
Schistosoma mansoni cpg binding protein 0.0032 0.0075 0.0106
Schistosoma mansoni 6-phosphofructokinase 0.0117 0.0353 0.0533
Trichomonas vaginalis glucosylceramidase, putative 0.0274 0.0873 1
Trichomonas vaginalis phosphofructokinase, putative 0.0031 0.0073 0.0542
Brugia malayi Pre-SET motif family protein 0.0224 0.0706 0.0703
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.002 0.0035 0.0048
Brugia malayi hypothetical protein 0.0337 0.108 0.1077
Brugia malayi Pre-SET motif family protein 0.0033 0.0077 0.0073
Echinococcus granulosus GPCR family 2 0.0019 0.0032 0.0043
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0018 0.0027 0.002
Trichomonas vaginalis glucosylceramidase, putative 0.018 0.0562 0.6326
Brugia malayi Thioredoxin reductase 0.0051 0.0136 0.0132
Schistosoma mansoni glutamate receptor kainate 0.0138 0.0425 0.0643
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.002 0.0035 0.0029
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0051 0.0136 0.1146
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0337 0.108 0.165
Mycobacterium tuberculosis Probable oxidoreductase 0.0129 0.0393 0.3415
Chlamydia trachomatis fructose-6-phosphate phosphotransferase 0.0031 0.0073 0.0413
Toxoplasma gondii hypothetical protein 0.0337 0.108 1
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0018 0.0027 0.0031
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0204 0.0642 0.098
Toxoplasma gondii thioredoxin reductase 0.0051 0.0136 0.1207
Echinococcus granulosus nmda type glutamate receptor 0.0493 0.1592 0.244
Trichomonas vaginalis phosphofructokinase, putative 0.0117 0.0353 0.3855
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.0105 0.0101
Echinococcus granulosus glutamate receptor subunit protein glur 0.0138 0.0425 0.0646
Loa Loa (eye worm) hypothetical protein 0.0337 0.108 0.108
Chlamydia trachomatis fructose-6-phosphate phosphotransferase 0.0031 0.0073 0.0413
Brugia malayi Cytochrome P450 family protein 0.0021 0.0037 0.0034
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.0337 0.108 0.108
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0337 0.108 0.165
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0337 0.108 0.1077
Schistosoma mansoni glutamate receptor AMPA 0.0138 0.0425 0.0643
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.0274 0.0873 0.0873
Entamoeba histolytica phosphofructokinase, putative 0.0117 0.0353 1
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.002 0.0035 0.0256
Loa Loa (eye worm) histone methyltransferase 0.0011 0.0004 0.0004
Toxoplasma gondii histone lysine methyltransferase SET1 0.0059 0.0163 0.1461
Onchocerca volvulus Glucosylceramidase homolog 0.018 0.0562 0.0764
Echinococcus multilocularis glutamate receptor 2 0.0138 0.0425 0.0646
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0129 0.0393 1
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.002 0.0035 0.0081
Loa Loa (eye worm) metabotropic glutamate receptor 8 0.0071 0.0203 0.0203
Schistosoma mansoni glutamate receptor NMDA 0.0138 0.0425 0.0643
Echinococcus multilocularis neuropeptide s receptor 0.0498 0.1609 0.2467
Mycobacterium ulcerans dihydrolipoamide dehydrogenase, LpdB 0.0018 0.0027 0.018
Echinococcus multilocularis dnaJ subfamily B 0.0434 0.14 0.2145
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0013 0.0012 0.0008
Echinococcus granulosus thioredoxin glutathione reductase 0.0051 0.0136 0.0203
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0018 0.0027 0.002
Loa Loa (eye worm) hypothetical protein 0.0071 0.0203 0.0203
Schistosoma mansoni sodium/chloride dependent transporter 0.0337 0.108 0.165
Trichomonas vaginalis glucosylceramidase, putative 0.0274 0.0873 1
Brugia malayi Latrophilin receptor protein 2 0.0019 0.0032 0.0028
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0337 0.108 0.165
Echinococcus multilocularis thioredoxin glutathione reductase 0.0051 0.0136 0.0203
Loa Loa (eye worm) metabotropic GABA-B receptor subtype 2 0.0071 0.0203 0.0203
Brugia malayi Cytochrome P450 family protein 0.0032 0.0074 0.007
Brugia malayi metabotropic glutamate receptor type 2 0.0071 0.0203 0.0199
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0018 0.0027 0.002
Loa Loa (eye worm) 6-phosphofructokinase 0.0117 0.0353 0.0353
Loa Loa (eye worm) hypothetical protein 0.0337 0.108 0.108
Loa Loa (eye worm) hypothetical protein 0.0071 0.0203 0.0203
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0018 0.0027 0.002
Echinococcus granulosus metabotropic glutamate receptor 2 0.0071 0.0203 0.0305
Trichomonas vaginalis 6-phosphofructokinase, putative 0.0031 0.0073 0.0542
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0337 0.108 1
Loa Loa (eye worm) hypothetical protein 0.1986 0.6512 0.6512
Loa Loa (eye worm) hypothetical protein 0.034 0.1089 0.1089
Entamoeba histolytica hypothetical protein 0.0071 0.0203 0.5264
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0337 0.108 0.165
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0037 0.009 0.0741
Toxoplasma gondii hypothetical protein 0.0337 0.108 1
Echinococcus granulosus sodium dependent neurotransmitter transporter 0.0337 0.108 0.1653
Trichomonas vaginalis glucosylceramidase, putative 0.0274 0.0873 1
Entamoeba histolytica pyrophosphate-dependent phosphofructokinase 0.0031 0.0073 0.1175
Echinococcus multilocularis metabotropic glutamate receptor 2 0.0071 0.0203 0.0305
Entamoeba histolytica phosphofructokinase, putative 0.0117 0.0353 1
Chlamydia trachomatis Ssodium-dependent amino acid transporter 0.0337 0.108 0.9488
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0018 0.0027 0.002
Loa Loa (eye worm) hypothetical protein 0.0033 0.0077 0.0077
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0033 0.0077 0.0112
Echinococcus multilocularis cpg binding protein 0.0032 0.0075 0.0109
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0018 0.0027 0.002
Loa Loa (eye worm) hypothetical protein 0.0337 0.108 0.108
Schistosoma mansoni glutamate receptor kainate 0.0138 0.0425 0.0643
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0039 0.0098 0.0145
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.0167 0.0167
Loa Loa (eye worm) hypothetical protein 0.3045 1 1
Brugia malayi phosphofructokinase 0.0117 0.0353 0.0349
Loa Loa (eye worm) hypothetical protein 0.0071 0.0203 0.0203
Loa Loa (eye worm) hypothetical protein 0.0071 0.0203 0.0203
Schistosoma mansoni 6-phosphofructokinase 0.0117 0.0353 0.0533
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0018 0.0027 0.002
Brugia malayi glutathione reductase 0.0051 0.0136 0.0132
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0066 0.0186 0.0276
Echinococcus multilocularis uncharacterized sodium dependent transporter 0.0337 0.108 0.1653
Echinococcus granulosus uncharacterized sodium dependent transporter 0.0337 0.108 0.1653
Onchocerca volvulus 0.0337 0.108 0.1568
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0033 0.0077 0.0108
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0031 0.0071 0.0102
Brugia malayi Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog 0.0011 0.0006 0.0003
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0018 0.0027 0.002
Mycobacterium ulcerans 6-phosphofructokinase 0.0117 0.0353 0.3065
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0116 0.035 0.3039
Plasmodium vivax glutathione reductase, putative 0.0051 0.0136 0.1036
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0337 0.108 0.165
Loa Loa (eye worm) hypothetical protein 0.0071 0.0203 0.0203
Echinococcus granulosus glutamate NMDA receptor subunit 0.0138 0.0425 0.0646
Treponema pallidum amino acid ABC transporter, periplasmic binding protein 0.0354 0.1137 0.1711
Trichomonas vaginalis glucosylceramidase, putative 0.019 0.0594 0.6703
Entamoeba histolytica phosphofructokinase, putative 0.0117 0.0353 1
Trichomonas vaginalis phosphofructokinase, putative 0.0031 0.0073 0.0542
Echinococcus multilocularis sodium dependent neurotransmitter transporter 0.0337 0.108 0.1653
Schistosoma mansoni tyrosine kinase 0.0071 0.0203 0.0301
Brugia malayi Cytochrome P450 family protein 0.0021 0.0037 0.0034
Schistosoma mansoni tyrosine kinase 0.0071 0.0203 0.0301
Trypanosoma brucei ATP-dependent 6-phosphofructokinase, glycosomal 0.0117 0.0353 0.0347
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0209 0.0658 0.1005
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.0031 0.0073 0.0435
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.002 0.0035 0.0029
Schistosoma mansoni voltage-gated potassium channel 0.0043 0.011 0.0159
Loa Loa (eye worm) hypothetical protein 0.0071 0.0203 0.0203
Schistosoma mansoni glutamate receptor kainate 0.0138 0.0425 0.0643
Echinococcus granulosus cpg binding protein 0.0032 0.0075 0.0109
Schistosoma mansoni hypothetical protein 0.0019 0.0032 0.0039
Schistosoma mansoni voltage-gated potassium channel 0.0043 0.011 0.0159
Trichomonas vaginalis glucosylceramidase, putative 0.018 0.0562 0.6326
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0245 0.0777 0.0774
Mycobacterium leprae PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE) 0.0117 0.0353 0.8975
Trichomonas vaginalis glucosylceramidase, putative 0.019 0.0594 0.6703
Onchocerca volvulus 0.1986 0.6512 1
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.0018 0.0027 0.002
Echinococcus multilocularis glutamate receptor 2 0.0209 0.0658 0.1005
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0013 0.0012 0.0008
Toxoplasma gondii exonuclease III APE 0.002 0.0035 0.027
Toxoplasma gondii phosphofructokinase PFKII 0.0031 0.0073 0.0617
Echinococcus multilocularis tyrosine kinase 0.0071 0.0203 0.0305
Echinococcus granulosus neuropeptide receptor A26 0.0498 0.1609 0.2467
Plasmodium vivax 6-phosphofructokinase, putative 0.0031 0.0073 0.0435
Schistosoma mansoni hypothetical protein 0.0041 0.0105 0.0151
Plasmodium vivax hypothetical protein, conserved 0.0337 0.108 1
Echinococcus multilocularis 6 phosphofructokinase 0.0117 0.0353 0.0536
Brugia malayi Sodium:neurotransmitter symporter family protein 0.1986 0.6512 0.6511
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0033 0.0077 0.0108
Echinococcus multilocularis glutamate receptor, ionotrophic, AMPA 3 0.0209 0.0658 0.1005
Mycobacterium ulcerans glutamine-binding lipoprotein GlnH 0.0354 0.1137 1
Mycobacterium tuberculosis Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase) 0.0117 0.0353 0.3065
Echinococcus multilocularis metabotropic glutamate receptor 5 0.0071 0.0203 0.0305
Loa Loa (eye worm) glutamate receptor 0.0071 0.0203 0.0203
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0011 0.0006 0.0004
Loa Loa (eye worm) hypothetical protein 0.0011 0.0006 0.0006
Plasmodium falciparum amino acid transporter, putative 0.0337 0.108 1
Trichomonas vaginalis phosphofructokinase, putative 0.0031 0.0073 0.0542
Plasmodium falciparum transporter, putative 0.0337 0.108 1
Schistosoma mansoni hypothetical protein 0.0019 0.0032 0.0039
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0209 0.0658 0.1005
Echinococcus multilocularis serotonin transporter 0.1986 0.6512 1
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0209 0.0658 0.1005
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.002 0.0035 0.0081
Echinococcus multilocularis receptor type guanylyl cyclase 0.0071 0.0203 0.0305
Echinococcus multilocularis sodium:chloride dependent neurotransmitter 0.0337 0.108 0.1653
Mycobacterium ulcerans flavoprotein disulfide reductase 0.0018 0.0027 0.018
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0018 0.0027 0.019
Mycobacterium ulcerans dihydrolipoamide dehydrogenase 0.0018 0.0027 0.018
Trypanosoma cruzi trypanothione reductase, putative 0.0051 0.0136 0.013
Schistosoma mansoni glutamate receptor AMPA 0.0138 0.0425 0.0643
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0116 0.035 0.3039
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0018 0.0027 0.0035
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0209 0.0658 0.1005
Toxoplasma gondii 6-phosphofructokinase 0.0031 0.0073 0.0617
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0039 0.0098 0.0098
Schistosoma mansoni cpg binding protein 0.0032 0.0075 0.0106
Loa Loa (eye worm) receptor family ligand binding region containing protein 0.0071 0.0203 0.0203
Loa Loa (eye worm) latrophilin receptor protein 2 0.0019 0.0032 0.0032
Trichomonas vaginalis phosphofructokinase, putative 0.0117 0.0353 0.3855
Plasmodium vivax thioredoxin reductase, putative 0.0051 0.0136 0.1036
Trypanosoma cruzi cytochrome P450, putative 0.0021 0.0037 0.0031
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0018 0.0027 0.002
Trichomonas vaginalis glucosylceramidase, putative 0.018 0.0562 0.6326
Leishmania major extracellular receptor, putative 0.0071 0.0203 0.0196
Echinococcus multilocularis atrial natriuretic peptide receptor 0.0071 0.0203 0.0305
Leishmania major ATP-dependent phosphofructokinase 0.0117 0.0353 0.0347
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0019 0.0032 0.0028
Echinococcus granulosus neuropeptide s receptor 0.0498 0.1609 0.2467
Plasmodium falciparum glutathione reductase 0.0051 0.0136 0.1036
Loa Loa (eye worm) norepinephrine transporter 0.1986 0.6512 0.6512
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.002 0.0035 0.1865
Echinococcus multilocularis 0.0011 0.0007 0.0004
Brugia malayi CXXC zinc finger family protein 0.0031 0.007 0.0066
Loa Loa (eye worm) 6-phosphofructokinase 0.0117 0.0353 0.0353
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0116 0.035 0.3039
Schistosoma mansoni hypothetical protein 0.0019 0.0032 0.0039
Brugia malayi Receptor family ligand binding region containing protein 0.0071 0.0203 0.0199
Onchocerca volvulus 0.0337 0.108 0.1568
Echinococcus multilocularis glutamate receptor 2 0.0071 0.0203 0.0305
Trichomonas vaginalis phosphofructokinase, putative 0.0031 0.0073 0.0542
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0031 0.0073 0.0071
Echinococcus granulosus uncharacterized sodium dependent transporter 0.0337 0.108 0.1653
Schistosoma mansoni ap endonuclease 0.002 0.0035 0.0045
Loa Loa (eye worm) glutamate receptor 1 0.0138 0.0425 0.0425
Schistosoma mansoni protein kinase 0.0071 0.0203 0.0301
Echinococcus multilocularis NMDA receptor 0.0138 0.0425 0.0646
Onchocerca volvulus 0.0033 0.0077 0.0011
Trichomonas vaginalis glucosylceramidase, putative 0.0274 0.0873 1
Trichomonas vaginalis glucosylceramidase, putative 0.0274 0.0873 1
Loa Loa (eye worm) cytochrome P450 0.0011 0.0007 0.0007
Brugia malayi Glutamate receptor 2 precursor 0.0138 0.0425 0.0421
Schistosoma mansoni sodium/chloride dependent transporter 0.0337 0.108 0.165
Schistosoma mansoni hypothetical protein 0.0138 0.0425 0.0643
Leishmania major C-8 sterol isomerase-like protein 0.3045 1 1
Echinococcus multilocularis neuropeptide receptor A26 0.0498 0.1609 0.2467
Trypanosoma cruzi ATP-dependent 6-phosphofructokinase, glycosomal 0.0117 0.0353 0.0347
Schistosoma mansoni metabotropic glutamate receptor 0.0071 0.0203 0.0301
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.0337 0.108 0.108
Loa Loa (eye worm) hypothetical protein 0.1986 0.6512 0.6512
Echinococcus multilocularis nmda type glutamate receptor 0.0493 0.1592 0.244
Trichomonas vaginalis glucosylceramidase, putative 0.018 0.0562 0.6326
Plasmodium vivax 6-phosphofructokinase, putative 0.0031 0.0073 0.0435
Trypanosoma cruzi cytochrome P450, putative 0.0021 0.0037 0.0031
Brugia malayi Sodium:neurotransmitter symporter family protein 1, putative 0.0337 0.108 0.1077
Brugia malayi 6-phosphofructokinase 0.0117 0.0353 0.0349
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0018 0.0027 0.002
Echinococcus granulosus histone lysine methyltransferase setb 0.0033 0.0077 0.0112
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0129 0.0393 0.3415
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.002 0.0035 0.0048
Loa Loa (eye worm) hypothetical protein 0.0071 0.0203 0.0203
Loa Loa (eye worm) hypothetical protein 0.1986 0.6512 0.6512
Trichomonas vaginalis phosphofructokinase, putative 0.0031 0.0073 0.0542
Treponema pallidum sodium- and chloride- dependent transporter 0.1986 0.6512 1
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.002 0.0035 0.0029
Loa Loa (eye worm) CXXC zinc finger family protein 0.0031 0.007 0.007
Toxoplasma gondii NADPH-glutathione reductase 0.0018 0.0027 0.019
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.002 0.0035 0.0256

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 0.3 nM Inhibition of [125I]-ovine-CRF binding to corticotropin releasing factor receptor 1 ChEMBL. 15509177
IC50 (binding) = 0.3 nM Inhibition of [125I]-ovine-CRF binding to corticotropin releasing factor receptor 1 ChEMBL. 15509177

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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