Detailed information for compound 335060

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 652.769 | Formula: C34H52O12
  • H donors: 2 H acceptors: 6 LogP: 2.83 Rotable bonds: 17
    Rule of 5 violations (Lipinski): 2
  • SMILES: CCCCCC(=O)O[C@@H]1[C@@H](OC(=O)/C(=C\C)/C)C(=C2[C@H]1[C@@](C)(OC(=O)C)C[C@@H]([C@]1([C@H]2O[C@H]([C@@]1(C)O)OCC)O)OC(=O)CCC)C
  • InChi: 1S/C34H52O12/c1-10-14-15-17-24(37)43-28-26-25(20(6)27(28)44-30(38)19(5)12-3)29-34(40,33(9,39)31(45-29)41-13-4)22(42-23(36)16-11-2)18-32(26,8)46-21(7)35/h12,22,26-29,31,39-40H,10-11,13-18H2,1-9H3/b19-12-/t22-,26+,27-,28-,29-,31+,32-,33+,34+/m0/s1
  • InChiKey: ZCNJJXBLADLETA-HOBZHRSSSA-N  

Network

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Synonyms

No synonyms found for this compound

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
Loa Loa (eye worm) hypothetical protein 0.0023 0.0125 0.0159
Echinococcus granulosus beta LACTamase domain containing family member 0.0023 0.0125 0.0125
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.036 0.5095 0.5095
Mycobacterium ulcerans lipase LipD 0.0023 0.0125 0.0234
Toxoplasma gondii thioredoxin reductase 0.0047 0.0477 1
Loa Loa (eye worm) hypothetical protein 0.0023 0.0125 0.0159
Giardia lamblia PHD finger protein 15 0.002 0.0084 0.2924
Brugia malayi 6-phosphofructokinase 0.0107 0.1367 0.1744
Toxoplasma gondii phosphofructokinase PFKII 0.0029 0.0217 0.4201
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0016 0.0029 0.003
Echinococcus granulosus metabotropic glutamate receptor 2 0.0054 0.058 0.058
Echinococcus granulosus ankyrin repeat and death domain containing protein 0.0014 0.000000012083 0.000000012083
Mycobacterium tuberculosis Probable reductase 0.0106 0.1355 0.325
Trichomonas vaginalis phosphofructokinase, putative 0.0107 0.1367 1
Brugia malayi Death domain containing protein 0.0014 0.000000012083 0.000000015415
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0023 0.0125 0.0234
Trichomonas vaginalis phosphofructokinase, putative 0.0107 0.1367 1
Mycobacterium tuberculosis Probable isocitrate lyase AceAb [second part] (isocitrase) (isocitratase) (Icl) 0.0293 0.4109 1
Trichomonas vaginalis phosphofructokinase, putative 0.0029 0.0217 0.1406
Echinococcus granulosus jumonji domain containing protein 0.0028 0.0199 0.0199
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0031 0.0253 0.0322
Trichomonas vaginalis esterase, putative 0.0023 0.0125 0.0713
Echinococcus multilocularis conserved hypothetical protein 0.0683 0.9848 1
Mycobacterium ulcerans esterase/lipase LipP 0.0023 0.0125 0.0234
Echinococcus multilocularis peregrin 0.002 0.0084 0.0085
Brugia malayi Serotonin receptor 0.0465 0.6648 0.8481
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0107 0.1367 1
Schistosoma mansoni metabotropic glutamate receptor 0.0054 0.058 0.1139
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0106 0.1355 0.325
Onchocerca volvulus 0.0065 0.0751 1
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0023 0.0125 0.0234
Trichomonas vaginalis phosphofructokinase, putative 0.0029 0.0217 0.1406
Echinococcus multilocularis 6 phosphofructokinase 0.0107 0.1367 0.1388
Onchocerca volvulus 0.0023 0.0125 0.1659
Loa Loa (eye worm) glutamate receptor 0.0025 0.0162 0.0207
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0023 0.0125 0.0159
Brugia malayi Thioredoxin reductase 0.0047 0.0477 0.0609
Onchocerca volvulus 0.0065 0.0751 1
Brugia malayi hypothetical protein 0.0065 0.0751 0.0958
Loa Loa (eye worm) hypothetical protein 0.0186 0.2534 0.3234
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.006 0.0669 0.0679
Chlamydia trachomatis fructose-6-phosphate phosphotransferase 0.0029 0.0217 1
Toxoplasma gondii phosphofructokinase domain-containing protein 0.0029 0.0217 0.4201
Mycobacterium tuberculosis Probable isocitrate lyase AceAa [first part] (isocitrase) (isocitratase) (Icl) 0.0293 0.4109 1
Echinococcus multilocularis MAM 0.0065 0.0751 0.0762
Schistosoma mansoni hypothetical protein 0.0021 0.0107 0.021
Mycobacterium tuberculosis Probable hydrolase 0.0023 0.0125 0.0234
Loa Loa (eye worm) hypothetical protein 0.0016 0.0033 0.0042
Schistosoma mansoni ankyrin 23/unc44 0.0014 0.000000012083 0.000000023714
Loa Loa (eye worm) hypothetical protein 0.0023 0.0125 0.0159
Loa Loa (eye worm) protein-tyrosine phosphatase 0.036 0.5095 0.6502
Mycobacterium tuberculosis Conserved protein 0.0023 0.0125 0.0234
Brugia malayi ERG2 and Sigma1 receptor like protein 0.0364 0.5158 0.658
Brugia malayi beta-lactamase family protein 0.0023 0.0125 0.0159
Echinococcus granulosus nuclear factor of activated T cells 5 0.0072 0.0859 0.0859
Echinococcus granulosus metabotropic glutamate receptor 5 0.0079 0.0951 0.0951
Schistosoma mansoni 6-phosphofructokinase 0.0107 0.1367 0.2683
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0106 0.1355 0.325
Trichomonas vaginalis phosphofructokinase, putative 0.0029 0.0217 0.1406
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0016 0.0029 0.0057
Plasmodium vivax 6-phosphofructokinase, putative 0.0029 0.0217 0.4201
Loa Loa (eye worm) TK/ALK protein kinase 0.0546 0.7836 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0023 0.0125 0.0245
Mycobacterium leprae PROBABLE ISOCITRATE LYASE AceA (ISOCITRASE) (ISOCITRATASE) (ICL) 0.0293 0.4109 1
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0144 0.1919 0.4632
Onchocerca volvulus 0.0023 0.0125 0.1659
Mycobacterium ulcerans isocitrate lyase Icl 0.0293 0.4109 1
Trypanosoma brucei C-8 sterol isomerase, putative 0.0364 0.5158 1
Loa Loa (eye worm) hypothetical protein 0.0031 0.0253 0.0322
Echinococcus multilocularis metabotropic glutamate receptor 2 0.0054 0.058 0.0589
Brugia malayi glutathione reductase 0.0047 0.0477 0.0609
Loa Loa (eye worm) hypothetical protein 0.0034 0.0293 0.0374
Trypanosoma cruzi hypothetical protein, conserved 0.0023 0.0125 0.0186
Schistosoma mansoni 6-phosphofructokinase 0.0107 0.1367 0.2683
Brugia malayi Protein-tyrosine phosphatase containing protein 0.036 0.5095 0.65
Echinococcus granulosus 6 phosphofructokinase 0.0107 0.1367 0.1367
Trichomonas vaginalis phosphofructokinase, putative 0.0107 0.1367 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.006 0.0669 0.1313
Plasmodium vivax hypothetical protein, conserved 0.0023 0.0125 0.2131
Mycobacterium tuberculosis Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase) 0.0107 0.1367 0.328
Echinococcus multilocularis geminin 0.0106 0.1359 0.138
Echinococcus multilocularis metabotropic glutamate receptor 5 0.0079 0.0951 0.0965
Toxoplasma gondii PHD-finger domain-containing protein 0.002 0.0084 0.1228
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.006 0.0669 0.0853
Brugia malayi latrophilin 2 splice variant baaae 0.0021 0.0107 0.0136
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0023 0.0125 0.0245
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0106 0.1355 0.325
Chlamydia trachomatis fructose-6-phosphate phosphotransferase 0.0029 0.0217 1
Mycobacterium tuberculosis Probable lipase LipD 0.0023 0.0125 0.0234
Echinococcus granulosus PHD finger protein rhinoceros 0.002 0.0084 0.0084
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0118 0.153 0.3526
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0023 0.0125 0.0159
Schistosoma mansoni metabotropic glutamate receptor 0.0031 0.0251 0.0492
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0023 0.0125 0.0234
Loa Loa (eye worm) hypothetical protein 0.0065 0.0751 0.0958
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.002 0.0084 0.0165
Brugia malayi Protein kinase domain containing protein 0.0014 0.000000012083 0.000000015415
Echinococcus granulosus thioredoxin glutathione reductase 0.0047 0.0477 0.0477
Loa Loa (eye worm) thioredoxin reductase 0.0047 0.0477 0.0609
Echinococcus granulosus geminin 0.0106 0.1359 0.1359
Trypanosoma cruzi C-8 sterol isomerase, putative 0.0364 0.5158 1
Brugia malayi hypothetical protein 0.0023 0.0124 0.0159
Trypanosoma brucei hypothetical protein, conserved 0.0023 0.0125 0.0186
Mycobacterium tuberculosis Isocitrate lyase Icl (isocitrase) (isocitratase) 0.0293 0.4109 1
Trichomonas vaginalis D-aminoacylase, putative 0.0023 0.0125 0.0713
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0023 0.0125 0.0234
Mycobacterium ulcerans 6-phosphofructokinase 0.0107 0.1367 0.328
Loa Loa (eye worm) hypothetical protein 0.0023 0.0125 0.0159
Schistosoma mansoni jumonji domain containing protein 0.0052 0.0553 0.1085
Trypanosoma cruzi hypothetical protein, conserved 0.0023 0.0125 0.0186
Loa Loa (eye worm) hypothetical protein 0.0312 0.439 0.5603
Entamoeba histolytica phosphofructokinase, putative 0.0107 0.1367 1
Brugia malayi Protein kinase domain containing protein 0.0546 0.7839 1
Loa Loa (eye worm) phosphofructokinase 0.0107 0.1367 0.1745
Loa Loa (eye worm) hypothetical protein 0.0079 0.0951 0.1213
Mycobacterium leprae Isocitrate lyase 0.0137 0.1815 0.4244
Loa Loa (eye worm) hypothetical protein 0.002 0.0084 0.0107
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0023 0.0124 0.0126
Loa Loa (eye worm) hypothetical protein 0.0479 0.6841 0.873
Schistosoma mansoni hypothetical protein 0.0106 0.1359 0.2667
Trypanosoma cruzi ATP-dependent 6-phosphofructokinase, glycosomal 0.0107 0.1367 0.2609
Plasmodium falciparum phd finger protein, putative 0.002 0.0084 0.1228
Brugia malayi jmjC domain containing protein 0.0024 0.0146 0.0186
Schistosoma mansoni jumonji/arid domain-containing protein 0.0024 0.0146 0.0286
Onchocerca volvulus Alhambra homolog 0.002 0.0084 0.112
Mycobacterium tuberculosis Probable esterase LipL 0.0023 0.0125 0.0234
Echinococcus granulosus peregrin 0.002 0.0084 0.0084
Trypanosoma brucei ATP-dependent 6-phosphofructokinase, glycosomal 0.0107 0.1367 0.2609
Trichomonas vaginalis phosphofructokinase, putative 0.0029 0.0217 0.1406
Schistosoma mansoni transcription factor LCR-F1 0.0023 0.0124 0.0244
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.006 0.0669 0.1313
Echinococcus multilocularis thioredoxin glutathione reductase 0.0047 0.0477 0.0484
Echinococcus multilocularis nuclear factor of activated T cells 5 0.0072 0.0859 0.0872
Plasmodium vivax hypothetical protein, conserved 0.002 0.0084 0.1228
Onchocerca volvulus 0.0023 0.0125 0.1659
Trichomonas vaginalis phosphofructokinase, putative 0.0107 0.1367 1
Trichomonas vaginalis phosphofructokinase, putative 0.0029 0.0217 0.1406
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0118 0.153 0.3677
Mycobacterium ulcerans beta-lactamase 0.0023 0.0125 0.0234
Loa Loa (eye worm) hypothetical protein 0.0023 0.0125 0.0159
Loa Loa (eye worm) 6-phosphofructokinase 0.0107 0.1367 0.1745
Leishmania major trypanothione reductase 0.0047 0.0477 0.0873
Brugia malayi Uncoordinated protein 44 0.0014 0.000000012083 0.000000015415
Echinococcus multilocularis lysine specific demethylase 5A 0.0024 0.0146 0.0148
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.0029 0.0217 0.4201
Entamoeba histolytica phosphofructokinase, putative 0.0107 0.1367 1
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0065 0.075 0.075
Brugia malayi metabotropic glutamate receptor subtype 5a (mGluR5a), putative 0.0058 0.0645 0.0822
Schistosoma mansoni hypothetical protein 0.0065 0.0751 0.1474
Brugia malayi PHD-finger family protein 0.002 0.0084 0.0107
Trichomonas vaginalis phosphofructokinase, putative 0.0029 0.0217 0.1406
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0031 0.0253 0.0322
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0106 0.1355 0.325
Loa Loa (eye worm) hypothetical protein 0.0065 0.0751 0.0958
Loa Loa (eye worm) hypothetical protein 0.0014 0.0002 0.0002
Mycobacterium tuberculosis Probable dehydrogenase 0.0106 0.1355 0.325
Plasmodium vivax glutathione reductase, putative 0.0047 0.0477 1
Trypanosoma cruzi trypanothione reductase, putative 0.0047 0.0477 0.0873
Loa Loa (eye worm) hypothetical protein 0.0065 0.0751 0.0958
Schistosoma mansoni hypothetical protein 0.0023 0.0124 0.0244
Loa Loa (eye worm) hypothetical protein 0.0023 0.0125 0.0159
Schistosoma mansoni metabotropic glutamate receptor 2 3 (mglur group 2) 0.0073 0.0862 0.1692
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.036 0.5095 0.5174
Plasmodium vivax 6-phosphofructokinase, putative 0.0029 0.0217 0.4201
Plasmodium falciparum glutathione reductase 0.0047 0.0477 1
Mycobacterium ulcerans isocitrate lyase AceAb 0.0293 0.4109 1
Plasmodium vivax thioredoxin reductase, putative 0.0047 0.0477 1
Entamoeba histolytica pyrophosphate-dependent phosphofructokinase 0.0029 0.0217 0.0748
Brugia malayi phosphofructokinase 0.0107 0.1367 0.1744
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0029 0.0217 0.1406
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0106 0.1355 0.3088
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0023 0.0124 0.0124
Mycobacterium tuberculosis Conserved protein 0.0023 0.0125 0.0234
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.006 0.0669 0.0669
Brugia malayi metabotropic glutamate receptor type 2 0.0031 0.0251 0.032
Loa Loa (eye worm) PHD-finger family protein 0.002 0.0084 0.0107
Schistosoma mansoni hypothetical protein 0.0106 0.1359 0.2667
Brugia malayi 6-phosphofructokinase 0.0107 0.1367 0.1744
Schistosoma mansoni hypothetical protein 0.002 0.0084 0.0165
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.006 0.0669 0.0669
Echinococcus granulosus lysine specific demethylase 5A 0.0024 0.0146 0.0146
Entamoeba histolytica phosphofructokinase, putative 0.0107 0.1367 1
Brugia malayi jmjC domain containing protein 0.0065 0.075 0.0956
Trichomonas vaginalis penicillin-binding protein, putative 0.0023 0.0125 0.0713
Loa Loa (eye worm) jmjC domain-containing protein 0.0024 0.0146 0.0186
Trichomonas vaginalis 6-phosphofructokinase, putative 0.0029 0.0217 0.1406
Trichomonas vaginalis D-aminoacylase, putative 0.0023 0.0125 0.0713
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0016 0.0029 0.5
Brugia malayi beta-lactamase 0.0023 0.0125 0.0159
Loa Loa (eye worm) hypothetical protein 0.0364 0.5158 0.6582
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0016 0.0029 0.0037
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.006 0.0669 0.0679
Brugia malayi hypothetical protein 0.012 0.1556 0.1985
Leishmania major C-8 sterol isomerase-like protein 0.0364 0.5158 1
Brugia malayi Bromodomain containing protein 0.002 0.0084 0.0107
Echinococcus granulosus MAM 0.0065 0.0751 0.0751
Toxoplasma gondii ABC1 family protein 0.0023 0.0125 0.2131
Echinococcus multilocularis beta LACTamase domain containing family member 0.0023 0.0125 0.0127
Echinococcus granulosus Ankyrin 0.0014 0.0002 0.0002
Loa Loa (eye worm) hypothetical protein 0.0021 0.0107 0.0136
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0016 0.0029 0.0029
Mycobacterium tuberculosis Conserved protein 0.0023 0.0125 0.0234
Brugia malayi Receptor family ligand binding region containing protein 0.0016 0.0033 0.0042
Schistosoma mansoni jumonji/arid domain-containing protein 0.0024 0.0146 0.0286
Loa Loa (eye worm) beta-lactamase 0.0023 0.0125 0.0159
Trichomonas vaginalis D-aminoacylase, putative 0.0023 0.0125 0.0713
Brugia malayi beta-lactamase family protein 0.0023 0.0125 0.0159
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0016 0.0029 0.5
Brugia malayi Metabotropic glutamate receptor precursor. 0.0064 0.0733 0.0935
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0118 0.153 0.3677
Echinococcus multilocularis jumonji domain containing protein 0.0028 0.0199 0.0202
Brugia malayi Calcitonin receptor-like protein seb-1 0.0031 0.0253 0.0322
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0065 0.075 0.0761
Toxoplasma gondii 6-phosphofructokinase 0.0029 0.0217 0.4201
Leishmania major ATP-dependent phosphofructokinase 0.0107 0.1367 0.2609
Echinococcus multilocularis ankyrin repeat and death domain containing protein 0.0014 0.000000012083 0.00000001227
Loa Loa (eye worm) metabotropic GABA-B receptor subtype 2 0.0016 0.0033 0.0042
Trichomonas vaginalis penicillin-binding protein, putative 0.0023 0.0125 0.0713
Giardia lamblia Pyrophosphate-fructose 6-phosphate 1-phosphotransferase alpha subunit 0.0029 0.0217 1
Trypanosoma brucei trypanothione reductase 0.0047 0.0477 0.0873
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0047 0.0477 0.1098
Echinococcus multilocularis Ankyrin 0.0014 0.0002 0.0002
Loa Loa (eye worm) receptor family ligand binding region containing protein 0.0016 0.0033 0.0042
Leishmania major hypothetical protein, conserved 0.0023 0.0125 0.0186
Mycobacterium ulcerans hypothetical protein 0.0023 0.0125 0.0234
Echinococcus multilocularis PHD finger protein rhinoceros 0.002 0.0084 0.0085
Loa Loa (eye worm) 6-phosphofructokinase 0.0107 0.1367 0.1745
Schistosoma mansoni hypothetical protein 0.0065 0.0751 0.1474
Mycobacterium tuberculosis Probable oxidoreductase 0.0118 0.153 0.3677
Schistosoma mansoni protein tyrosine phosphatase non-receptor type nt1 0.036 0.5095 1
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0591 0.8496 0.8628
Plasmodium falciparum thioredoxin reductase 0.0047 0.0477 1
Schistosoma mansoni retinoblastoma-binding protein 4 (rbbp4) 0.0014 0.0002 0.0003
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.006 0.0669 0.1313
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.006 0.0669 0.0854
Loa Loa (eye worm) glutathione reductase 0.0047 0.0477 0.0609
Mycobacterium tuberculosis Probable lipase LipE 0.0023 0.0125 0.0234
Loa Loa (eye worm) jmjC domain-containing protein 0.0041 0.0396 0.0505
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.0029 0.0217 0.4201
Toxoplasma gondii PHD-finger domain-containing protein 0.002 0.0084 0.1228
Mycobacterium leprae PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE) 0.0107 0.1367 0.3119
Loa Loa (eye worm) glutamate receptor 0.0064 0.0733 0.0936

Activities

Activity type Activity value Assay description Source Reference
RIC50 (binding) = 0.52 Inhibitory potency against sarco- endoplasmic reticulum calcium-ATPase in relative to thapsigargin ChEMBL. 15828839

Phenotypes

Whole-cell/tissue/organism interactions

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

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

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

No external resources registered for this compound

Bibliographic References

1 literature reference was collected for this gene.

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