Detailed information for compound 372609

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 412.484 | Formula: C25H24N4O2
  • H donors: 1 H acceptors: 4 LogP: 4.91 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1nnc(o1)c1cccnc1c1ccc(cc1)C(=O)Nc1ccc(cc1)C(C)(C)C
  • InChi: 1S/C25H24N4O2/c1-16-28-29-24(31-16)21-6-5-15-26-22(21)17-7-9-18(10-8-17)23(30)27-20-13-11-19(12-14-20)25(2,3)4/h5-15H,1-4H3,(H,27,30)
  • InChiKey: NROSMDXNTIGNJU-UHFFFAOYSA-N  


Substructure search Similarity search

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Rattus norvegicus Vanilloid receptor Starlite/ChEMBL References
Homo sapiens transient receptor potential cation channel, subfamily V, member 1 Starlite/ChEMBL References

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
Onchocerca volvulus 0.0161 0.19 0.335
Plasmodium vivax ataxin-2 like protein, putative 0.0024 0.0084 0.0151
Leishmania major prostaglandin f synthase, putative 0.0161 0.19 1
Echinococcus multilocularis voltage gated potassium channel subunit 0.0047 0.0379 0.0379
Toxoplasma gondii 1-deoxy-D-xylulose 5-phosphate reductoisomerase, putative 0.0437 0.5571 1
Giardia lamblia Aldose reductase 0.0161 0.19 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0161 0.19 0.19
Plasmodium falciparum ataxin-2 like protein, putative 0.0024 0.0084 0.0151
Brugia malayi hypothetical protein 0.0024 0.0084 0.0188
Onchocerca volvulus 0.0161 0.19 0.335
Entamoeba histolytica alcohol dehydrogenase, putative 0.0047 0.0379 0.1994
Brugia malayi Matrixin family protein 0.0103 0.1134 0.2533
Loa Loa (eye worm) oxidoreductase 0.0161 0.19 0.3516
Leishmania major cathepsin L-like protease 0.0062 0.0583 0.3067
Echinococcus granulosus aldehyde reductase 0.0114 0.128 0.128
Onchocerca volvulus 0.0161 0.19 0.335
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0161 0.19 0.19
Brugia malayi Matrixin family protein 0.0043 0.0327 0.0731
Trichomonas vaginalis malate dehydrogenase, putative 0.0043 0.0333 0.118
Loa Loa (eye worm) hypothetical protein 0.0043 0.0329 0.0609
Echinococcus granulosus microtubule associated protein 2 0.067 0.8673 0.8673
Trypanosoma brucei aldo/keto reductase, putative 0.0047 0.0379 0.1994
Giardia lamblia Aldose reductase 0.0161 0.19 1
Plasmodium falciparum cysteine protease ATG4, putative 0.0022 0.0056 0.01
Plasmodium vivax aldehyde reductase, putative 0.0047 0.0379 0.068
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0029 0.0144 0.0144
Trichomonas vaginalis malate dehydrogenase, putative 0.0043 0.0333 0.118
Echinococcus granulosus aldo keto reductase 0.0161 0.19 0.19
Trypanosoma cruzi cytosolic malate dehydrogenase, putative 0.0043 0.0333 0.175
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0161 0.19 0.19
Toxoplasma gondii oxidoreductase, aldo/keto reductase family protein 0.0047 0.0379 0.068
Echinococcus multilocularis jumonji domain containing protein 0.0039 0.0283 0.0283
Trichomonas vaginalis aldo-keto reductase, putative 0.0161 0.19 0.6742
Echinococcus granulosus voltage gated potassium channel subunit 0.0047 0.0379 0.0379
Plasmodium vivax hypothetical protein, conserved 0.0028 0.0135 0.0243
Plasmodium falciparum aldehyde reductase, putative 0.0047 0.0379 0.068
Leishmania major aldehyde reductase, putative,oxidoreductase, putative 0.0161 0.19 1
Trypanosoma cruzi AUT2/APG4/ATG4 cysteine peptidase, putative 0.0022 0.0056 0.0293
Schistosoma mansoni jumonji/arid domain-containing protein 0.0034 0.0214 0.0247
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0028 0.013 0.013
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0062 0.0583 0.3067
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0161 0.19 0.19
Leishmania major aldo-keto reductase-like protein 0.0161 0.19 1
Onchocerca volvulus Matrilysin homolog 0.0095 0.102 0.168
Mycobacterium tuberculosis Probable 1-deoxy-D-xylulose 5-phosphate reductoisomerase Dxr (DXP reductoisomerase) (1-deoxyxylulose-5-phosphate reductoisomeras 0.0105 0.1156 0.5256
Schistosoma mansoni matrix metallopeptidase-7 (M10 family) 0.0043 0.0327 0.0378
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0161 0.19 0.19
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0161 0.19 0.4245
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0029 0.0144 0.0144
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0355 0.4477 0.8283
Echinococcus multilocularis transient receptor potential ion channel A 0.0091 0.0971 0.0971
Entamoeba histolytica malate dehydrogenase,cytoplasmic, putative 0.0043 0.0333 0.175
Echinococcus multilocularis aldo keto reductase 0.0161 0.19 0.19
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0161 0.19 0.19
Schistosoma mansoni autophagin-1 (C54 family) 0.0057 0.052 0.06
Schistosoma mansoni hypothetical protein 0.0114 0.1273 0.1468
Schistosoma mansoni protein tyrosine phosphatase non-receptor type nt1 0.0355 0.4477 0.5162
Loa Loa (eye worm) apoptosis regulator protein 0.0114 0.1273 0.2356
Trypanosoma brucei AUT2/APG4/ATG4 cysteine peptidase, putative 0.0057 0.052 0.2739
Trichomonas vaginalis aldo-keto reductase, putative 0.0047 0.0379 0.1345
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0057 0.0511 0.269
Echinococcus granulosus jumonji domain containing protein 0.0039 0.0283 0.0283
Toxoplasma gondii aldo/keto reductase family oxidoreductase 0.0047 0.0379 0.068
Loa Loa (eye worm) hypothetical protein 0.0424 0.5404 1
Loa Loa (eye worm) hypothetical protein 0.0033 0.0199 0.0368
Trypanosoma cruzi aldo/keto reductase, putative 0.0161 0.19 1
Plasmodium vivax oxidoreductase, aldo/keto reductase domain containing protein 0.0047 0.0379 0.068
Treponema pallidum 1-deoxy-D-xylulose 5-phosphate reductoisomerase 0.0437 0.5571 0.5
Brugia malayi PHD-finger family protein 0.0028 0.0135 0.0302
Echinococcus granulosus aldo keto reductase 0.0161 0.19 0.19
Echinococcus multilocularis microtubule associated protein 2 0.067 0.8673 0.8673
Trichomonas vaginalis aldo/keto reductase, putative 0.0161 0.19 0.6742
Echinococcus granulosus Peptidase C54 0.0057 0.052 0.052
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0048 0.0403 0.0899
Trichomonas vaginalis malate dehydrogenase, putative 0.0043 0.0333 0.118
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0161 0.19 0.19
Schistosoma mansoni malate dehydrogenase 0.0043 0.0333 0.0383
Brugia malayi jmjC domain containing protein 0.0034 0.0214 0.0479
Schistosoma mansoni aldo-keto reductase 0.0161 0.19 0.2191
Onchocerca volvulus 0.023 0.2822 0.51
Echinococcus granulosus matrix metallopeptidase 7 M10 family 0.0155 0.1827 0.1827
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0093 0.0992 0.0992
Trypanosoma cruzi PAB1-binding protein , putative 0.0024 0.0084 0.0443
Schistosoma mansoni hypothetical protein 0.0104 0.1139 0.1314
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase 0.0057 0.052 0.1847
Echinococcus granulosus cysteine protease atg4b 0.0057 0.052 0.052
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0044 0.035 0.035
Echinococcus granulosus hypothetical protein 0.0161 0.19 0.19
Trypanosoma cruzi aldo/keto reductase, putative 0.0047 0.0379 0.1994
Loa Loa (eye worm) jmjC domain-containing protein 0.0034 0.0214 0.0397
Echinococcus multilocularis peregrin 0.0028 0.0135 0.0135
Echinococcus multilocularis Peptidase C54 0.0057 0.052 0.052
Echinococcus multilocularis lysine specific demethylase 5A 0.0034 0.0214 0.0214
Trichomonas vaginalis aldo-keto reductase, putative 0.0161 0.19 0.6742
Schistosoma mansoni hypothetical protein 0.0061 0.0565 0.0652
Mycobacterium leprae PROBABLE OXIDOREDUCTASE 0.0161 0.19 0.2993
Entamoeba histolytica peptidase, C54 family 0.0057 0.052 0.2739
Brugia malayi Calcitonin receptor-like protein seb-1 0.0048 0.0403 0.0899
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0161 0.19 0.4245
Loa Loa (eye worm) oxidoreductase 0.0161 0.19 0.3516
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0355 0.4477 1
Mycobacterium leprae PROBABLE 1-DEOXY-D-XYLULOSE 5-PHOSPHATE REDUCTOISOMERASE DXR (DXP REDUCTOISOMERASE) (1-DEOXYXYLULOSE-5-PHOSPHATE REDUCTOISOMERAS 0.0437 0.5571 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.035 0.0403
Loa Loa (eye worm) malate dehydrogenase 0.0043 0.0333 0.0615
Loa Loa (eye worm) glutamate-cysteine ligase modifier subunit 0.0047 0.0379 0.0701
Trypanosoma brucei PAB1-binding protein , putative 0.0024 0.0084 0.0443
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0062 0.0583 0.3067
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0144 0.0166
Leishmania major prostaglandin f2-alpha synthase/D-arabinose dehydrogenase 0.0161 0.19 1
Trichomonas vaginalis set domain proteins, putative 0.023 0.2819 1
Loa Loa (eye worm) jmjC domain-containing protein 0.0058 0.0536 0.0992
Onchocerca volvulus 0.0161 0.19 0.335
Mycobacterium tuberculosis Conserved protein 0.0047 0.0379 0.0296
Leishmania major cytosolic malate dehydrogenase 0.0043 0.0333 0.175
Schistosoma mansoni family C54 unassigned peptidase (C54 family) 0.0057 0.052 0.06
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0161 0.19 0.19
Schistosoma mansoni jumonji domain containing protein 0.0074 0.0739 0.0852
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0161 0.19 0.19
Mycobacterium ulcerans oxidoreductase 0.0161 0.19 0.2993
Echinococcus granulosus cytosolic malate dehydrogenase 0.0043 0.0333 0.0333
Echinococcus multilocularis aldehyde reductase 0.0114 0.128 0.128
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase 0.0057 0.052 0.1847
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0044 0.035 0.035
Leishmania major cathepsin L-like protease 0.0062 0.0583 0.3067
Loa Loa (eye worm) hypothetical protein 0.0043 0.0327 0.0606
Schistosoma mansoni family C54 unassigned peptidase (C54 family) 0.0057 0.052 0.06
Loa Loa (eye worm) hypothetical protein 0.0032 0.0183 0.0339
Entamoeba histolytica aldose reductase, putative 0.0161 0.19 1
Brugia malayi jmjC domain containing protein 0.0093 0.0992 0.2216
Brugia malayi Bromodomain containing protein 0.0028 0.0135 0.0302
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0161 0.19 0.19
Mycobacterium ulcerans 1-deoxy-D-xylulose 5-phosphate reductoisomerase 0.0437 0.5571 1
Onchocerca volvulus 0.0161 0.19 0.335
Trypanosoma cruzi cysteine peptidase, Clan CA, family C54, putative 0.0022 0.0056 0.0293
Schistosoma mansoni potassium channel beta 0.0047 0.0379 0.0437
Trichomonas vaginalis malate dehydrogenase, putative 0.0043 0.0333 0.118
Entamoeba histolytica malate dehydrogenase, putative 0.0043 0.0333 0.175
Loa Loa (eye worm) hypothetical protein 0.0043 0.0327 0.0606
Loa Loa (eye worm) PHD-finger family protein 0.0028 0.0135 0.025
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.035 0.0403
Brugia malayi Matrix metalloprotease, N-terminal domain containing protein 0.0052 0.0451 0.1008
Giardia lamblia Malate dehydrogenase 0.0043 0.0333 0.1118
Echinococcus multilocularis matrix metallopeptidase 7 (M10 family) 0.0155 0.1827 0.1827
Loa Loa (eye worm) hypothetical protein 0.0052 0.0451 0.0835
Schistosoma mansoni transient receptor potential channel 4 0.0102 0.1116 0.1287
Entamoeba histolytica alcohol dehydrogenase, putative 0.0047 0.0379 0.1994
Echinococcus granulosus short transient receptor potential channel 6 0.007 0.0696 0.0696
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0044 0.035 0.0781
Toxoplasma gondii aldo-keto reductase 0.0047 0.0379 0.068
Trypanosoma brucei cytosolic malate dehydrogenase 0.0043 0.0333 0.175
Echinococcus granulosus transient receptor potential ion channel A 0.0091 0.0971 0.0971
Toxoplasma gondii PHD-finger domain-containing protein 0.0028 0.0135 0.0243
Loa Loa (eye worm) hypothetical protein 0.0048 0.0403 0.0745
Echinococcus multilocularis cytosolic malate dehydrogenase 0.0043 0.0333 0.0333
Trichomonas vaginalis malate and lactate dehydrogenase, putative 0.0043 0.0333 0.118
Schistosoma mansoni hypothetical protein 0.0114 0.1273 0.1468
Trypanosoma brucei aldo-keto reductase, putative 0.0161 0.19 1
Brugia malayi Malate dehydrogenase, cytoplasmic 0.0043 0.0333 0.0743
Loa Loa (eye worm) matrixin family protein 0.0095 0.102 0.1888
Trichomonas vaginalis aldo-keto reductase, putative 0.0161 0.19 0.6742
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0161 0.19 0.19
Trichomonas vaginalis alcohol dehydrogenase, putative 0.0047 0.0379 0.1345
Toxoplasma gondii aldose reductase, putative 0.0161 0.19 0.3411
Echinococcus multilocularis EGFP:Bcl2 fusion protein 0.077 1 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0047 0.0379 0.1345
Leishmania major cathepsin L-like protease 0.0062 0.0583 0.3067
Trichomonas vaginalis aldo/keto reductase, putative 0.0161 0.19 0.6742
Onchocerca volvulus Matrix metalloproteinase homolog 0.0095 0.102 0.168
Trypanosoma brucei RNA helicase, putative 0.0104 0.1139 0.5995
Mycobacterium tuberculosis Probable peptidoglycan hydrolase 0.0052 0.0451 0.0758
Loa Loa (eye worm) hypothetical protein 0.0057 0.052 0.0963
Onchocerca volvulus 0.0061 0.0565 0.0816
Brugia malayi Hemopexin family protein 0.0061 0.0565 0.1262
Trichomonas vaginalis malate dehydrogenase, putative 0.0034 0.0209 0.0741
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0062 0.0583 0.3067
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0161 0.19 0.6742
Trypanosoma cruzi aldo-keto reductase 0.0161 0.19 1
Trypanosoma cruzi major cysteine proteinase, putative 0.0049 0.0406 0.2138
Plasmodium falciparum phd finger protein, putative 0.0028 0.0135 0.0243
Loa Loa (eye worm) hypothetical protein 0.0102 0.1116 0.2066
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0062 0.0583 0.3067
Toxoplasma gondii LsmAD domain-containing protein 0.0024 0.0084 0.0151
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0161 0.19 0.19
Schistosoma mansoni transient receptor potential channel 0.007 0.0692 0.0798
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0161 0.19 0.4245
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0161 0.19 0.19
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0062 0.0583 0.3067
Echinococcus granulosus PHD finger protein rhinoceros 0.0028 0.0135 0.0135
Loa Loa (eye worm) hypothetical protein 0.0089 0.0947 0.1753
Onchocerca volvulus Phospholipase A2 homolog 0.0424 0.5404 1
Echinococcus granulosus histone lysine methyltransferase setb 0.0029 0.0144 0.0144
Loa Loa (eye worm) hypothetical protein 0.0024 0.0084 0.0156
Leishmania major aldo/keto reductase, putative,aldo/keto reductase family-like protein 0.0047 0.0379 0.1994
Loa Loa (eye worm) matrix metalloproteinase 0.0043 0.0327 0.0606
Mycobacterium ulcerans hydrolase 0.0052 0.0451 0.0227
Plasmodium falciparum 1-deoxy-D-xylulose 5-phosphate reductoisomerase 0.0437 0.5571 1
Plasmodium falciparum ataxin-2 like protein, putative 0.0024 0.0084 0.0151
Trichomonas vaginalis aldo-keto reductase, putative 0.0161 0.19 0.6742
Trypanosoma brucei cysteine peptidase, Clan CA, family C54, putative 0.0022 0.0056 0.0293
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase 0.0057 0.052 0.1847
Mycobacterium leprae Conserved hypothetical protein 0.0114 0.128 0.1808
Echinococcus multilocularis cytosolic malate dehydrogenase 0.0043 0.0333 0.0333
Trichomonas vaginalis malate dehydrogenase, putative 0.0043 0.0333 0.118
Entamoeba histolytica aldose reductase, putative 0.0161 0.19 1
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0044 0.035 0.0647
Trypanosoma cruzi cysteine peptidase, putative 0.0062 0.0583 0.3067
Trypanosoma cruzi cruzipain precursor, putative 0.0062 0.0583 0.3067
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0048 0.0403 0.0745
Trichomonas vaginalis malate dehydrogenase, putative 0.0043 0.0333 0.118
Schistosoma mansoni hypothetical protein 0.0028 0.0135 0.0156
Trypanosoma cruzi cysteine peptidase, putative 0.0062 0.0583 0.3067
Loa Loa (eye worm) hypothetical protein 0.0043 0.0327 0.0606
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0161 0.19 0.4245
Leishmania major AUT2/APG4/ATG4 cysteine peptidase, putative 0.0057 0.052 0.2739
Loa Loa (eye worm) hypothetical protein 0.0059 0.0546 0.1011
Trichomonas vaginalis aldo-keto reductase, putative 0.0161 0.19 0.6742
Entamoeba histolytica peptidase, C54 family 0.0022 0.0056 0.0293
Brugia malayi Matrixin family protein 0.0043 0.0327 0.0731
Schistosoma mansoni apoptosis regulator bax 0.0114 0.1273 0.1468
Echinococcus granulosus peregrin 0.0028 0.0135 0.0135
Onchocerca volvulus Matrilysin homolog 0.0043 0.0327 0.0365
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0028 0.0135 0.0156
Schistosoma mansoni transient receptor potential channel 0.0102 0.1116 0.1287
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.035 0.0403
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0044 0.035 0.035
Schistosoma mansoni hypothetical protein 0.0033 0.0199 0.0229
Trypanosoma cruzi cysteine peptidase, putative 0.0062 0.0583 0.3067
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase 0.0057 0.052 0.1847
Brugia malayi Peptidase family C54 containing protein 0.0057 0.052 0.1163
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0144 0.0166
Loa Loa (eye worm) hypothetical protein 0.0161 0.19 0.3516
Schistosoma mansoni transient receptor potential channel 0.007 0.0696 0.0802
Brugia malayi Transient-receptor-potential like protein 0.0043 0.0329 0.0735
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase 0.0057 0.052 0.1847
Schistosoma mansoni malate dehydrogenase 0.0043 0.0333 0.0383
Echinococcus multilocularis PHD finger protein rhinoceros 0.0028 0.0135 0.0135
Loa Loa (eye worm) hypothetical protein 0.0114 0.1273 0.2356
Trichomonas vaginalis aldo-keto reductase, putative 0.0161 0.19 0.6742
Onchocerca volvulus 0.0029 0.0144 0.0017
Schistosoma mansoni bcl-2 homologous antagonist/killer (bak) 0.0114 0.1273 0.1468
Loa Loa (eye worm) hypothetical protein 0.0028 0.0135 0.025
Mycobacterium leprae PROBABLE HYDROLASE 0.0052 0.0451 0.0227
Loa Loa (eye worm) oxidoreductase 0.0161 0.19 0.3516
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0161 0.19 0.19
Loa Loa (eye worm) oxidoreductase 0.0161 0.19 0.3516
Plasmodium vivax SET domain protein, putative 0.0029 0.0144 0.0259
Schistosoma mansoni jumonji/arid domain-containing protein 0.0034 0.0214 0.0247
Echinococcus granulosus lysine specific demethylase 5A 0.0034 0.0214 0.0214
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0044 0.035 0.035
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0202 0.2447 0.4528
Echinococcus multilocularis transient receptor potential gamma protein 0.0102 0.1116 0.1116
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0161 0.19 0.6742
Trypanosoma brucei prostaglandin f synthase 0.0161 0.19 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0161 0.19 0.6742
Schistosoma mansoni pol-related 0.0161 0.19 0.2191
Echinococcus granulosus Bcl 2 ous antagonist:killer 0.0114 0.1273 0.1273
Trichomonas vaginalis aldo-keto reductase, putative 0.0047 0.0379 0.1345
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0029 0.0144 0.0259
Trichomonas vaginalis aldo-keto reductase, putative 0.0161 0.19 0.6742
Trichomonas vaginalis aldo-keto reductase, putative 0.0161 0.19 0.6742
Trichomonas vaginalis malate dehydrogenase, putative 0.0043 0.0333 0.118
Loa Loa (eye worm) matrixin family protein 0.0103 0.1134 0.2098
Trichomonas vaginalis malate and lactate dehydrogenase, putative 0.0043 0.0333 0.118
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0161 0.19 0.19
Leishmania major AUT2/APG4/ATG4 cysteine peptidase, putative 0.0022 0.0056 0.0293
Wolbachia endosymbiont of Brugia malayi 1-deoxy-D-xylulose 5-phosphate reductoisomerase 0.0437 0.5571 1
Echinococcus granulosus aldo keto reductase 0.0161 0.19 0.19
Echinococcus multilocularis short transient receptor potential channel 6 0.007 0.0692 0.0692
Loa Loa (eye worm) oxidoreductase 0.0161 0.19 0.3516
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0062 0.0583 0.3067
Plasmodium falciparum aldo-keto reductase, putative 0.0047 0.0379 0.068
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0161 0.19 0.19
Trypanosoma cruzi PAB1-binding protein , putative 0.0024 0.0084 0.0443
Loa Loa (eye worm) hypothetical protein 0.0049 0.0404 0.0748
Trichomonas vaginalis conserved hypothetical protein 0.0047 0.0379 0.1345
Trichomonas vaginalis malate dehydrogenase, putative 0.0043 0.0333 0.118
Echinococcus multilocularis short transient receptor potential channel 6 0.007 0.0696 0.0696
Trichomonas vaginalis malate and lactate dehydrogenase, putative 0.0043 0.0333 0.118
Mycobacterium leprae Possible oxidoreductase 0.0047 0.0379 0.0089
Toxoplasma gondii PHD-finger domain-containing protein 0.0028 0.0135 0.0243
Echinococcus granulosus cytosolic malate dehydrogenase 0.0043 0.0333 0.0333
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0161 0.19 0.19
Echinococcus granulosus short transient receptor potential channel 6 0.007 0.0692 0.0692
Entamoeba histolytica aldose reductase, putative 0.0161 0.19 1
Schistosoma mansoni aldo-keto reductase 0.0161 0.19 0.2191
Trichomonas vaginalis malate dehydrogenase, putative 0.0043 0.0333 0.118
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0062 0.0583 0.3067
Echinococcus multilocularis aldo keto reductase 0.0161 0.19 0.19
Onchocerca volvulus 0.0161 0.19 0.335
Onchocerca volvulus Phospholipase A2 homolog 0.0089 0.0947 0.1541
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0062 0.0583 0.3067
Echinococcus multilocularis aldo keto reductase 0.0161 0.19 0.19
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0161 0.19 0.6742
Echinococcus granulosus TRP transient receptor potential channel 0.0043 0.0329 0.0329
Trichomonas vaginalis malate dehydrogenase, putative 0.0043 0.0333 0.118
Trichomonas vaginalis malate and lactate dehydrogenase, putative 0.0043 0.0333 0.118
Trichomonas vaginalis aldo-keto reductase, putative 0.0161 0.19 0.6742
Trichomonas vaginalis malate dehydrogenase, putative 0.0043 0.0333 0.118
Onchocerca volvulus 0.0047 0.0379 0.0463
Echinococcus multilocularis TRP (transient receptor potential) channel 0.0043 0.0329 0.0329
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.0355 0.4477 0.4477
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0062 0.0583 0.3067
Trichomonas vaginalis aldo-keto reductase, putative 0.0161 0.19 0.6742
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0161 0.19 0.19
Entamoeba histolytica peptidase, C54 family 0.0022 0.0056 0.0293
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0029 0.0144 0.0166
Brugia malayi Pre-SET motif family protein 0.0029 0.0144 0.0322
Echinococcus multilocularis cysteine protease atg4b 0.0057 0.052 0.052
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0062 0.0583 0.3067
Entamoeba histolytica peptidase, C54 family 0.0022 0.0056 0.0293
Brugia malayi Matrixin family protein 0.0043 0.0327 0.0731
Loa Loa (eye worm) hypothetical protein 0.0029 0.0144 0.0267
Entamoeba histolytica peptidase, C54 family 0.0022 0.0056 0.0293
Mycobacterium tuberculosis Probable oxidoreductase 0.0161 0.19 1
Brugia malayi glutamate-cysteine ligase modifier subunit 0.0047 0.0379 0.0847
Trypanosoma cruzi cytosolic malate dehydrogenase, putative 0.0043 0.0333 0.175
Schistosoma mansoni hypothetical protein 0.0114 0.1273 0.1468
Brugia malayi Pre-SET motif family protein 0.0202 0.2447 0.5466
Brugia malayi Apoptosis regulator proteins, Bcl-2 family protein 0.0114 0.1273 0.2844
Mycobacterium ulcerans hypothetical protein 0.0047 0.0379 0.0089
Trichomonas vaginalis aldo/keto reductase, putative 0.0161 0.19 0.6742
Brugia malayi Phospholipase A2 family protein 0.0089 0.0947 0.2116
Trypanosoma cruzi AUT2/APG4/ATG4 cysteine peptidase, putative 0.0057 0.052 0.2739
Onchocerca volvulus 0.0043 0.0327 0.0365
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0161 0.19 0.19
Brugia malayi latrophilin 2 splice variant baaae 0.0033 0.0199 0.0444
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.0355 0.4477 0.4477
Echinococcus multilocularis aldo keto reductase 0.0161 0.19 0.19
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0161 0.19 0.19
Leishmania major hypothetical protein, conserved 0.0024 0.0084 0.0443
Echinococcus multilocularis Bcl 2 ous antagonist:killer 0.0114 0.1273 0.1273
Brugia malayi Matrixin family protein 0.0043 0.0327 0.0731
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0062 0.0583 0.3067
Trichomonas vaginalis aldo-keto reductase, putative 0.0161 0.19 0.6742
Plasmodium vivax 1-deoxy-D-xylulose 5-phosphate reductoisomerase, putative 0.0437 0.5571 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0144 0.0166
Brugia malayi NADH-dependent xylose reductase 0.0047 0.0379 0.0847
Schistosoma mansoni microtubule-associated protein tau 0.067 0.8673 1
Echinococcus granulosus aldo keto reductase family 1, member B4 0.0047 0.0379 0.0379
Echinococcus granulosus transient receptor potential gamma protein 0.0102 0.1116 0.1116
Toxoplasma gondii autophagy-related cysteine peptidase atg4, putative 0.0022 0.0056 0.01
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0093 0.0992 0.0992
Chlamydia trachomatis 1-deoxy-D-xylulose 5-phosphate reductoisomerase 0.0437 0.5571 1

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) = 34 nM Antagonist activity against low pH(5.0-5.5)-activated rat VR1 ChEMBL. 16870426
IC50 (functional) = 34 nM Antagonist activity against low pH(5.0-5.5)-activated rat VR1 ChEMBL. 16870426
IC50 (functional) = 387 nM Antagonist activity against capsaicin-activated human VR1 by FLIPR assay ChEMBL. 16870426
IC50 (functional) = 387 nM Antagonist activity against capsaicin-activated human VR1 by FLIPR assay ChEMBL. 16870426

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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