Detailed information for compound 1080536

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 381.296 | Formula: C19H22Cl2N2O2
  • H donors: 0 H acceptors: 1 LogP: 2.9 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(C1(C)CC1(Cl)Cl)c1cn(c2c1cccc2)CCN1CCOCC1
  • InChi: 1S/C19H22Cl2N2O2/c1-18(13-19(18,20)21)17(24)15-12-23(16-5-3-2-4-14(15)16)7-6-22-8-10-25-11-9-22/h2-5,12H,6-11,13H2,1H3
  • InChiKey: HJXCSZMIFFJCCI-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens cannabinoid receptor 1 (brain) Starlite/ChEMBL References
Homo sapiens cannabinoid receptor 2 (macrophage) 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
Leishmania major trypanothione reductase 0.0201 0.0996 1
Schistosoma mansoni thyroid hormone receptor 0.0441 0.2343 0.29
Giardia lamblia NADH oxidase lateral transfer candidate 0.007 0.0261 0.5
Onchocerca volvulus 0.0026 0.0018 0.0132
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.007 0.0261 0.0323
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0033 0.0055 0.0068
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.007 0.0261 0.0323
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0184 0.0902 0.1326
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.1465 0.808 1
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.007 0.0261 0.0063
Plasmodium falciparum thioredoxin reductase 0.007 0.0261 0.0323
Mycobacterium tuberculosis Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot 0.007 0.0261 0.0325
Loa Loa (eye worm) hypothetical protein 0.0034 0.0064 0.0079
Plasmodium falciparum glutathione reductase 0.007 0.0261 0.0323
Mycobacterium tuberculosis Conserved protein 0.0184 0.0902 0.1326
Brugia malayi Smad1 0.0036 0.0071 0.0088
Schistosoma mansoni cellular tumor antigen P53 0.0265 0.1354 0.1676
Brugia malayi MH2 domain containing protein 0.0036 0.0071 0.0088
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0458 0.2437 0.3723
Onchocerca volvulus 0.0265 0.1354 1
Loa Loa (eye worm) hypothetical protein 0.0033 0.0055 0.0068
Loa Loa (eye worm) transcription factor SMAD2 0.0523 0.2804 0.347
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0033 0.0055 0.0055
Mycobacterium tuberculosis Conserved protein 0.0184 0.0902 0.1326
Trypanosoma cruzi hypothetical protein, conserved 0.0184 0.0902 0.903
Toxoplasma gondii hypothetical protein 0.0505 0.27 0.3341
Leishmania major hypothetical protein, conserved 0.0184 0.0902 0.903
Mycobacterium tuberculosis Probable oxidoreductase 0.0509 0.2724 0.417
Trichomonas vaginalis D-aminoacylase, putative 0.0184 0.0902 0.6608
Schistosoma mansoni ferritin light chain 0.0061 0.0212 0.0263
Mycobacterium ulcerans acyl-CoA synthetase 0.0046 0.0129 0.0081
Echinococcus granulosus FTZ F1 alpha 0.0033 0.0055 0.0055
Loa Loa (eye worm) hypothetical protein 0.0265 0.1354 0.1676
Brugia malayi MH1 domain containing protein 0.0036 0.0071 0.0088
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0033 0.0055 0.0055
Echinococcus granulosus chromobox protein 1 0.014 0.0656 0.0656
Brugia malayi chromobox protein homolog 3 0.0079 0.0311 0.0385
Schistosoma mansoni smad1 5 8 and 0.0036 0.0071 0.0088
Loa Loa (eye worm) thioredoxin reductase 0.0201 0.0996 0.1233
Mycobacterium ulcerans lipase LipD 0.0184 0.0902 0.1046
Plasmodium vivax glutathione reductase, putative 0.0201 0.0996 0.1233
Loa Loa (eye worm) hypothetical protein 0.0033 0.0055 0.0068
Loa Loa (eye worm) hypothetical protein 0.0034 0.0064 0.0079
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.1465 0.808 1
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0033 0.0055 0.0068
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.007 0.0261 0.0063
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0033 0.0055 0.0408
Mycobacterium tuberculosis Bacterioferritin BfrB 0.0061 0.0212 0.0248
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.1465 0.808 0.808
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0408 0.2159 0.2159
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.007 0.0261 0.0261
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0184 0.0902 0.1046
Brugia malayi TAR-binding protein 0.0466 0.2483 0.3074
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.007 0.0261 0.2415
Trichomonas vaginalis conserved hypothetical protein 0.0056 0.0183 0.134
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.096 0.5252 0.8119
Trichomonas vaginalis chromobox protein, putative 0.0084 0.0345 0.2525
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0079 0.0311 0.23
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.007 0.0261 0.2415
Trichomonas vaginalis glutaminase, putative 0.0267 0.1366 1
Loa Loa (eye worm) MH2 domain-containing protein 0.0523 0.2804 0.347
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.1465 0.808 1
Brugia malayi AMP-binding enzyme family protein 0.0046 0.0129 0.0159
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0033 0.0055 0.0068
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.007 0.0261 0.0247
Echinococcus multilocularis tumor protein p63 0.1808 1 1
Loa Loa (eye worm) beta-lactamase 0.0184 0.0902 0.1117
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0046 0.0129 0.0118
Schistosoma mansoni lamin 0.0026 0.0018 0.0022
Echinococcus granulosus peptidase Clp S14 family 0.096 0.5252 0.5252
Loa Loa (eye worm) hypothetical protein 0.0033 0.0055 0.0068
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0046 0.0129 0.0081
Onchocerca volvulus 0.0033 0.0055 0.0408
Loa Loa (eye worm) hypothetical protein 0.0184 0.0902 0.1117
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.007 0.0261 0.2415
Mycobacterium tuberculosis Probable esterase LipL 0.0184 0.0902 0.1326
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0034 0.0064 0.0016
Mycobacterium leprae Probable lipase LipE 0.0184 0.0902 0.0973
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0033 0.0055 0.0068
Mycobacterium ulcerans acyl-CoA synthetase 0.0046 0.0129 0.0081
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0046 0.0129 0.0081
Mycobacterium leprae PROBABLE BACTERIOFERRITIN BFRA 0.0061 0.0212 0.0105
Loa Loa (eye worm) hypothetical protein 0.0034 0.0064 0.0079
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0033 0.0055 0.0068
Brugia malayi beta-lactamase 0.0184 0.0902 0.1117
Loa Loa (eye worm) hypothetical protein 0.0184 0.0902 0.1117
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0509 0.2724 0.3263
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0184 0.0902 0.1326
Brugia malayi steroid hormone receptor 0.0033 0.0055 0.0068
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.096 0.5252 0.8119
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.007 0.0261 0.2415
Onchocerca volvulus 0.0184 0.0902 0.6664
Onchocerca volvulus Protein ultraspiracle homolog 0.0033 0.0055 0.0408
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0458 0.2437 0.3723
Onchocerca volvulus 0.0026 0.0018 0.0132
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0408 0.2159 0.2159
Loa Loa (eye worm) hypothetical protein 0.0184 0.0902 0.1117
Onchocerca volvulus 0.0046 0.0129 0.095
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.007 0.0261 0.0323
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0033 0.0055 0.0068
Trichomonas vaginalis penicillin-binding protein, putative 0.0184 0.0902 0.6608
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0505 0.27 0.3162
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.007 0.0261 0.0261
Echinococcus multilocularis FTZ F1 alpha 0.0033 0.0055 0.0055
Schistosoma mansoni ferritin 0.0061 0.0212 0.0263
Schistosoma mansoni Smad4 0.0036 0.0071 0.0088
Toxoplasma gondii NADPH-glutathione reductase 0.007 0.0261 0.0323
Brugia malayi MH2 domain containing protein 0.0523 0.2804 0.347
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.007 0.0261 0.2415
Schistosoma mansoni hypothetical protein 0.0038 0.0082 0.0102
Echinococcus multilocularis tar DNA binding protein 0.0466 0.2483 0.2483
Echinococcus multilocularis ferritin 0.0061 0.0212 0.0212
Trypanosoma cruzi trypanothione reductase, putative 0.007 0.0261 0.2415
Schistosoma mansoni glutaminase 0.0267 0.1366 0.169
Schistosoma mansoni peptidase Clp (S14 family) 0.1465 0.808 1
Plasmodium falciparum thioredoxin reductase 0.0201 0.0996 0.1233
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0033 0.0055 0.0055
Entamoeba histolytica acyl-CoA synthetase, putative 0.0046 0.0129 0.0492
Echinococcus multilocularis chromobox protein 1 0.014 0.0656 0.0656
Mycobacterium tuberculosis Probable bacterioferritin BfrA 0.0061 0.0212 0.0248
Loa Loa (eye worm) TAR-binding protein 0.0466 0.2483 0.3074
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0033 0.0055 0.0068
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0033 0.0055 0.0068
Loa Loa (eye worm) Smad1 0.0036 0.0071 0.0088
Entamoeba histolytica hypothetical protein 0.049 0.2616 1
Onchocerca volvulus 0.0184 0.0902 0.6664
Echinococcus multilocularis expressed protein 0.0061 0.0212 0.0212
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0033 0.0055 0.0068
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.007 0.0261 0.2415
Schistosoma mansoni microtubule-associated protein tau 0.0825 0.4491 0.5558
Echinococcus granulosus smad 0.0036 0.0071 0.0071
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0033 0.0055 0.0068
Schistosoma mansoni apoferritin-2 0.0061 0.0212 0.0263
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.007 0.0261 0.2415
Plasmodium vivax thioredoxin reductase, putative 0.0201 0.0996 0.1233
Schistosoma mansoni smad1 5 8 and 0.0036 0.0071 0.0088
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0026 0.0018 0.0022
Trichomonas vaginalis chromobox protein, putative 0.014 0.0656 0.4805
Loa Loa (eye worm) hypothetical protein 0.0026 0.0015 0.0019
Loa Loa (eye worm) hypothetical protein 0.0046 0.0129 0.0159
Trichomonas vaginalis penicillin-binding protein, putative 0.0184 0.0902 0.6608
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.007 0.0261 0.2415
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.1465 0.808 1
Mycobacterium ulcerans esterase/lipase LipP 0.0184 0.0902 0.1046
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0033 0.0055 0.0055
Trichomonas vaginalis ferritin, putative 0.0061 0.0212 0.1553
Schistosoma mansoni tar DNA-binding protein 0.0466 0.2483 0.3074
Schistosoma mansoni chromobox protein 0.014 0.0656 0.0812
Loa Loa (eye worm) hypothetical protein 0.0079 0.0311 0.0385
Plasmodium falciparum acyl-CoA synthetase 0.0034 0.0064 0.0079
Echinococcus multilocularis smad 0.0036 0.0071 0.0071
Schistosoma mansoni tar DNA-binding protein 0.0466 0.2483 0.3074
Echinococcus multilocularis peptidase Clp (S14 family) 0.096 0.5252 0.5252
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.1465 0.808 0.808
Brugia malayi Heterochromatin protein 1 0.014 0.0656 0.0812
Schistosoma mansoni retinoic acid receptor RXR 0.0033 0.0055 0.0068
Toxoplasma gondii thioredoxin reductase 0.0201 0.0996 0.1233
Loa Loa (eye worm) hypothetical protein 0.0184 0.0902 0.1117
Leishmania major dihydrolipoamide dehydrogenase, putative 0.007 0.0261 0.2415
Entamoeba histolytica acyl-coA synthetase, putative 0.0046 0.0129 0.0492
Schistosoma mansoni transcription factor LCR-F1 0.049 0.2616 0.3238
Leishmania major 4-coumarate:coa ligase-like protein 0.0046 0.0129 0.1046
Mycobacterium ulcerans beta-lactamase 0.0184 0.0902 0.1046
Brugia malayi Intermediate filament tail domain containing protein 0.0026 0.0018 0.0022
Loa Loa (eye worm) glutathione reductase 0.0201 0.0996 0.1233
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0033 0.0055 0.0068
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0505 0.27 0.3341
Schistosoma mansoni apoferritin-2 0.0061 0.0212 0.0263
Schistosoma mansoni smad 0.0036 0.0071 0.0088
Trichomonas vaginalis conserved hypothetical protein 0.0079 0.0311 0.228
Entamoeba histolytica acyl-CoA synthetase, putative 0.0046 0.0129 0.0492
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0033 0.0055 0.0068
Mycobacterium tuberculosis Probable reductase 0.0458 0.2437 0.3723
Treponema pallidum NADH oxidase 0.007 0.0261 0.0063
Mycobacterium ulcerans dihydrolipoamide dehydrogenase 0.007 0.0261 0.0247
Loa Loa (eye worm) hypothetical protein 0.0026 0.0018 0.0022
Brugia malayi beta-lactamase family protein 0.0184 0.0902 0.1117
Loa Loa (eye worm) glutaminase 0.0267 0.1366 0.169
Loa Loa (eye worm) hypothetical protein 0.0038 0.0082 0.0102
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0033 0.0055 0.0068
Brugia malayi hypothetical protein 0.0028 0.0027 0.0034
Mycobacterium tuberculosis Conserved protein 0.0184 0.0902 0.1326
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0509 0.2724 0.417
Loa Loa (eye worm) hypothetical protein 0.0034 0.0064 0.0079
Loa Loa (eye worm) hypothetical protein 0.0033 0.0055 0.0068
Brugia malayi RNA binding protein 0.0466 0.2483 0.3074
Schistosoma mansoni ferritin 0.0061 0.0212 0.0263
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.1465 0.808 1
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0046 0.0129 0.0081
Echinococcus multilocularis lamin dm0 0.0026 0.0018 0.0018
Echinococcus granulosus thioredoxin glutathione reductase 0.0201 0.0996 0.0996
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0033 0.0055 0.0055
Echinococcus granulosus mothers against decapentaplegic 5 0.0036 0.0071 0.0071
Trypanosoma cruzi trypanothione reductase, putative 0.0201 0.0996 1
Brugia malayi glutathione reductase 0.0201 0.0996 0.1233
Echinococcus granulosus Smad4 0.0036 0.0071 0.0071
Schistosoma mansoni hypothetical protein 0.049 0.2616 0.3238
Schistosoma mansoni lamin 0.0026 0.0018 0.0022
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0458 0.2437 0.3723
Trichomonas vaginalis D-aminoacylase, putative 0.0184 0.0902 0.6608
Plasmodium falciparum ataxin-2 like protein, putative 0.0028 0.0027 0.0034
Brugia malayi RNA recognition motif domain containing protein 0.0466 0.2483 0.3074
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0084 0.0345 0.2546
Loa Loa (eye worm) hypothetical protein 0.0046 0.0129 0.0159
Onchocerca volvulus Bile acid receptor homolog 0.0033 0.0055 0.0408
Schistosoma mansoni thyroid hormone receptor 0.0441 0.2343 0.29
Entamoeba histolytica hypothetical protein 0.049 0.2616 1
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0036 0.0071 0.0071
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.1465 0.808 1
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.007 0.0261 0.2415
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0036 0.0071 0.0088
Schistosoma mansoni smad1 5 8 and 0.0036 0.0071 0.0088
Echinococcus granulosus tar DNA binding protein 0.0466 0.2483 0.2483
Loa Loa (eye worm) hypothetical protein 0.0184 0.0902 0.1117
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0184 0.0902 0.1326
Mycobacterium tuberculosis Possible penicillin-binding protein 0.1176 0.6457 1
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.1465 0.808 1
Trichomonas vaginalis conserved hypothetical protein 0.0079 0.0311 0.228
Entamoeba histolytica hypothetical protein 0.049 0.2616 1
Leishmania major dihydrolipoamide dehydrogenase, putative 0.007 0.0261 0.2415
Loa Loa (eye worm) hypothetical protein 0.1465 0.808 1
Loa Loa (eye worm) hypothetical protein 0.0062 0.0216 0.0268
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0033 0.0055 0.0068
Brugia malayi Nuclear hormone receptor-like 1 0.0033 0.0055 0.0068
Schistosoma mansoni ferritin light chain 0.0061 0.0212 0.0263
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0033 0.0055 0.0068
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.007 0.0261 0.0323
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.007 0.0261 0.0323
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0509 0.2724 0.417
Schistosoma mansoni RAR-like nuclear receptor 0.0033 0.0055 0.0068
Leishmania major 4-coumarate:coa ligase-like protein 0.0046 0.0129 0.1046
Trichomonas vaginalis mercuric reductase, putative 0.007 0.0261 0.1914
Loa Loa (eye worm) MH2 domain-containing protein 0.0036 0.0071 0.0088
Brugia malayi MH2 domain containing protein 0.0036 0.0071 0.0088
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0033 0.0055 0.0068
Echinococcus granulosus chromobox protein 1 0.014 0.0656 0.0656
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0033 0.0055 0.0068
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0046 0.0129 0.0118
Echinococcus multilocularis thioredoxin glutathione reductase 0.0201 0.0996 0.0996
Loa Loa (eye worm) hypothetical protein 0.0033 0.0055 0.0068
Schistosoma mansoni ferritin 0.0061 0.0212 0.0263
Schistosoma mansoni tar DNA-binding protein 0.0466 0.2483 0.3074
Echinococcus granulosus microtubule associated protein 2 0.0825 0.4491 0.4491
Leishmania major acetoin dehydrogenase e3 component-like protein 0.007 0.0261 0.2415
Brugia malayi AMP-binding enzyme family protein 0.0046 0.0129 0.0159
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0184 0.0902 0.1117
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0033 0.0055 0.0068
Loa Loa (eye worm) hypothetical protein 0.0033 0.0055 0.0068
Mycobacterium tuberculosis Probable hydrolase 0.0184 0.0902 0.1326
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0033 0.0055 0.0068
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0051 0.0158 0.0195
Loa Loa (eye worm) hypothetical protein 0.0033 0.0055 0.0068
Loa Loa (eye worm) hypothetical protein 0.0028 0.0027 0.0034
Mycobacterium leprae ATP-dependent Clp protease proteolytic subunit 1 0.0505 0.27 0.3233
Schistosoma mansoni tar DNA-binding protein 0.0466 0.2483 0.3074
Brugia malayi Calcitonin receptor-like protein seb-1 0.0055 0.018 0.0222
Brugia malayi beta-lactamase family protein 0.0184 0.0902 0.1117
Echinococcus granulosus ecdysone induced protein 78C 0.0033 0.0055 0.0055
Echinococcus granulosus beta LACTamase domain containing family member 0.0184 0.0902 0.0902
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0033 0.0055 0.0055
Brugia malayi MH1 domain containing protein 0.0036 0.0071 0.0088
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0055 0.018 0.0222
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0033 0.0055 0.0068
Trichomonas vaginalis chromobox protein, putative 0.0084 0.0345 0.2525
Trichomonas vaginalis glutathione reductase, putative 0.007 0.0261 0.1914
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.049 0.2616 0.2616
Mycobacterium ulcerans hypothetical protein 0.0184 0.0902 0.1046
Echinococcus multilocularis lamin 0.0026 0.0018 0.0018
Onchocerca volvulus 0.0184 0.0902 0.6664
Brugia malayi AMP-binding enzyme family protein 0.0046 0.0129 0.0159
Mycobacterium ulcerans bacterioferritin BfrA 0.0061 0.0212 0.0185
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0458 0.2437 0.3723
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0033 0.0055 0.0055
Brugia malayi Steroid receptor seven-up type 2 0.0033 0.0055 0.0068
Brugia malayi intermediate filament protein 0.0026 0.0018 0.0022
Loa Loa (eye worm) hypothetical protein 0.0046 0.0129 0.0159
Mycobacterium ulcerans flavoprotein disulfide reductase 0.007 0.0261 0.0247
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0184 0.0902 0.1117
Schistosoma mansoni chromobox protein 0.014 0.0656 0.0812
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0033 0.0055 0.0055
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0033 0.0055 0.0055
Schistosoma mansoni steroid hormone receptor ad4bp 0.0033 0.0055 0.0068
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0033 0.0055 0.0055
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0033 0.0055 0.0068
Schistosoma mansoni hypothetical protein 0.0408 0.2159 0.2673
Brugia malayi Thioredoxin reductase 0.0201 0.0996 0.1233
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0184 0.0902 0.1117
Mycobacterium ulcerans acyl-CoA synthetase 0.0046 0.0129 0.0081
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0033 0.0055 0.0055
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0505 0.27 0.3341
Echinococcus multilocularis thyroid hormone receptor alpha 0.0441 0.2343 0.2343
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0033 0.0055 0.0068
Brugia malayi photoreceptor-specific nuclear receptor 0.0033 0.0055 0.0068
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0033 0.0055 0.0055
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.096 0.5252 0.6443
Brugia malayi ecdysteroid receptor 0.0033 0.0055 0.0068
Mycobacterium tuberculosis Probable lipase LipD 0.0184 0.0902 0.1326
Plasmodium vivax hypothetical protein, conserved 0.0184 0.0902 0.1117
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.007 0.0261 0.0323
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.1465 0.808 1
Echinococcus multilocularis beta LACTamase domain containing family member 0.0184 0.0902 0.0902
Loa Loa (eye worm) heterochromatin protein 1 0.014 0.0656 0.0812
Echinococcus granulosus TGF beta signal transducer SmadC 0.0036 0.0071 0.0071
Brugia malayi latrophilin 2 splice variant baaae 0.0038 0.0082 0.0102
Loa Loa (eye worm) hypothetical protein 0.0055 0.018 0.0222
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0033 0.0055 0.0055
Mycobacterium ulcerans bacterioferritin BfrB 0.0061 0.0212 0.0185
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0033 0.0055 0.0068
Schistosoma mansoni coup transcription factor 0.0033 0.0055 0.0068
Echinococcus multilocularis musashi 0.0026 0.0018 0.0018
Schistosoma mansoni nuclear hormone receptor 0.0033 0.0055 0.0068
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0051 0.0158 0.0195
Echinococcus multilocularis microtubule associated protein 2 0.0825 0.4491 0.4491
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0046 0.0129 0.0081
Echinococcus granulosus lamin 0.0026 0.0018 0.0018
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.1465 0.808 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0033 0.0055 0.0068
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0033 0.0055 0.0068
Brugia malayi glutaminase DH11.1 0.0267 0.1366 0.169
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.049 0.2616 0.2616
Mycobacterium tuberculosis Probable dehydrogenase 0.0458 0.2437 0.3723
Loa Loa (eye worm) intermediate filament protein 0.0026 0.0018 0.0022
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.007 0.0261 0.2415
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.007 0.0261 0.2415
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0184 0.0902 0.1117
Schistosoma mansoni tar DNA-binding protein 0.0466 0.2483 0.3074
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.1465 0.808 1
Schistosoma mansoni ferritin 0.0061 0.0212 0.0263
Onchocerca volvulus 0.0062 0.0216 0.1598
Plasmodium falciparum glutathione reductase 0.0201 0.0996 0.1233
Echinococcus granulosus lamin dm0 0.0026 0.0018 0.0018
Echinococcus granulosus intermediate filament protein 0.0026 0.0018 0.0018
Loa Loa (eye worm) RNA binding protein 0.0466 0.2483 0.3074
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0466 0.2483 0.3074
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.007 0.0261 0.0323
Trypanosoma brucei hypothetical protein, conserved 0.0184 0.0902 0.903
Plasmodium vivax acyl-CoA synthetase, putative 0.0034 0.0064 0.0079
Mycobacterium ulcerans glutaminase 0.0267 0.1366 0.1624
Loa Loa (eye worm) hypothetical protein 0.0184 0.0902 0.1117
Leishmania major 4-coumarate:coa ligase-like protein 0.0046 0.0129 0.1046
Loa Loa (eye worm) MH1 domain-containing protein 0.0036 0.0071 0.0088
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0201 0.0996 0.1473
Plasmodium vivax ataxin-2 like protein, putative 0.0028 0.0027 0.0034
Trypanosoma cruzi hypothetical protein, conserved 0.0184 0.0902 0.903
Echinococcus granulosus expressed protein 0.0061 0.0212 0.0212
Schistosoma mansoni intermediate filament proteins 0.0026 0.0018 0.0022
Trichomonas vaginalis D-aminoacylase, putative 0.0184 0.0902 0.6608
Mycobacterium leprae conserved hypothetical protein 0.0184 0.0902 0.0973
Loa Loa (eye worm) steroid hormone receptor 0.0033 0.0055 0.0068
Echinococcus granulosus ferritin 0.0061 0.0212 0.0212
Toxoplasma gondii ABC1 family protein 0.0184 0.0902 0.1117
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.007 0.0261 0.2415
Brugia malayi nuclear receptor NHR-88 0.0033 0.0055 0.0068
Brugia malayi nuclear hormone receptor 0.0033 0.0055 0.0068
Mycobacterium tuberculosis Probable lipase LipE 0.0184 0.0902 0.1326
Loa Loa (eye worm) hypothetical protein 0.0034 0.0064 0.0079
Mycobacterium ulcerans dihydrolipoamide dehydrogenase, LpdB 0.007 0.0261 0.0247
Trypanosoma brucei trypanothione reductase 0.0201 0.0996 1
Brugia malayi Probable ClpP-like protease 0.1465 0.808 1
Loa Loa (eye worm) hypothetical protein 0.0033 0.0055 0.0068
Trichomonas vaginalis chromobox protein, putative 0.014 0.0656 0.4805
Echinococcus multilocularis chromobox protein 1 0.014 0.0656 0.0656
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0033 0.0055 0.0068
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.007 0.0261 0.2415
Echinococcus multilocularis ecdysone induced protein 78C 0.0033 0.0055 0.0055
Echinococcus multilocularis mothers against decapentaplegic 5 0.0036 0.0071 0.0071
Echinococcus multilocularis Smad4 0.0036 0.0071 0.0071
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.1465 0.808 1
Entamoeba histolytica hypothetical protein 0.049 0.2616 1
Trichomonas vaginalis esterase, putative 0.0184 0.0902 0.6608
Loa Loa (eye worm) glutaminase 2 0.0267 0.1366 0.169
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0458 0.2437 0.2903
Brugia malayi hypothetical protein 0.049 0.2616 0.3238
Trichomonas vaginalis conserved hypothetical protein 0.0056 0.0183 0.134
Toxoplasma gondii LsmAD domain-containing protein 0.0028 0.0027 0.0034
Plasmodium falciparum ataxin-2 like protein, putative 0.0028 0.0027 0.0034
Mycobacterium ulcerans hypothetical protein 0.0046 0.0129 0.0081
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0055 0.018 0.0222

Activities

Activity type Activity value Assay description Source Reference
Activity (functional) = 33 % Agonist activity at human recombinant CB2 receptor expressed in HEK293 cells coexpressing Galphaq/o5 assessed as calcium mobilization by FLIPR assay relative to CP-55940 ChEMBL. 19921781
EC50 (functional) = 716 nM Agonist activity at human recombinant CB2 receptor expressed in HEK293 cells coexpressing Galphaq/o5 assessed as calcium mobilization by FLIPR assay ChEMBL. 19921781
Ki (binding) > 5 Displacement of [3H]CP-55940 from human recombinant CB1 receptor expressed in CHO cells ChEMBL. 19921781
Ki (binding) > 6 Displacement of [3H]CP-55940 from human recombinant CB2 receptor expressed in HEK293 cells ChEMBL. 19921781
Ki (binding) > 1000 nM Displacement of [3H]CP-55940 from human recombinant CB2 receptor expressed in HEK293 cells ChEMBL. 19921781
Ki (binding) > 10000 nM Displacement of [3H]CP-55940 from human recombinant CB1 receptor expressed in CHO cells ChEMBL. 19921781

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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