Detailed information for compound 446532

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 437.442 | Formula: C25H34Cl2O2
  • H donors: 2 H acceptors: 2 LogP: 8.52 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCCCCC1(CC1(Cl)Cl)c1cc(O)c(c(c1)O)[C@@H]1C=C(C)CCC1C(=C)C
  • InChi: 1S/C25H34Cl2O2/c1-5-6-7-8-11-24(15-25(24,26)27)18-13-21(28)23(22(29)14-18)20-12-17(4)9-10-19(20)16(2)3/h12-14,19-20,28-29H,2,5-11,15H2,1,3-4H3/t19?,20-,24?/m1/s1
  • InChiKey: WSOQRILWMPFFKN-ITGJCUMNSA-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
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0071 0.0039 0.0234
Trypanosoma brucei importin beta-1 subunit, putative 0.0023 0.0003 0.0012
Echinococcus granulosus endonuclease exonuclease phosphatase 0.014 0.0091 0.0089
Toxoplasma gondii LsmAD domain-containing protein 0.0048 0.0022 0.0115
Loa Loa (eye worm) RNA binding protein 0.0142 0.0092 0.0565
Brugia malayi TAR-binding protein 0.0142 0.0092 0.0565
Brugia malayi PHD-finger family protein 0.0027 0.0006 0.0029
Mycobacterium leprae Probable anthranilate phosphoribosyltransferase TrpD 0.3758 0.2812 1
Leishmania major aldehyde reductase, putative,oxidoreductase, putative 0.2163 0.1613 1
Echinococcus multilocularis aldo keto reductase 0.2163 0.1613 0.1611
Brugia malayi mbt repeat family protein 0.0033 0.0011 0.0058
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.2163 0.1613 0.1611
Echinococcus granulosus snurportin 1 0.0247 0.0172 0.017
Trypanosoma cruzi aldo/keto reductase, putative 0.2163 0.1613 1
Trichomonas vaginalis aldo-keto reductase, putative 0.2163 0.1613 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.2163 0.1613 0.1611
Onchocerca volvulus 0.2163 0.1613 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.2163 0.1613 0.1611
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0049 0.0022 0.5
Schistosoma mansoni jumonji/arid domain-containing protein 0.0032 0.001 0.0054
Mycobacterium ulcerans oxidoreductase 0.2163 0.1613 0.1612
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0071 0.0039 0.0037
Loa Loa (eye worm) hypothetical protein 0.0027 0.0006 0.0029
Trypanosoma cruzi aldo-keto reductase 0.2163 0.1613 1
Loa Loa (eye worm) hypothetical protein 0.003 0.0009 0.0046
Giardia lamblia Aldose reductase 0.2163 0.1613 1
Trypanosoma brucei aldo-keto reductase, putative 0.2163 0.1613 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.2163 0.1613 0.1611
Loa Loa (eye worm) hypothetical protein 0.2163 0.1613 1
Loa Loa (eye worm) oxidoreductase 0.2163 0.1613 1
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0087 0.0052 0.005
Brugia malayi mbt repeat family protein 0.0033 0.0011 0.0058
Leishmania major prostaglandin f2-alpha synthase/D-arabinose dehydrogenase 0.2163 0.1613 1
Schistosoma mansoni jumonji domain containing protein 0.0069 0.0038 0.0227
Mycobacterium tuberculosis Probable thymidine phosphorylase DeoA (tdrpase) (pyrimidine phosphorylase) 1.3313 1 1
Trichomonas vaginalis alcohol dehydrogenase, putative 0.0627 0.0457 0.2834
Treponema pallidum exodeoxyribonuclease (exoA) 0.0049 0.0022 0.5
Echinococcus granulosus aldo keto reductase family 1 member B4 0.2163 0.1613 0.1611
Onchocerca volvulus 0.2163 0.1613 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0627 0.0457 0.2834
Brugia malayi Calcitonin receptor-like protein seb-1 0.003 0.0009 0.0046
Plasmodium falciparum phd finger protein, putative 0.0027 0.0006 0.0058
Mycobacterium tuberculosis Conserved protein 0.0627 0.0457 0.0436
Onchocerca volvulus 0.2163 0.1613 1
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0038 0.0014 0.008
Trypanosoma brucei PAB1-binding protein , putative 0.0048 0.0022 0.0127
Echinococcus granulosus aldo keto reductase family 1 member B4 0.2163 0.1613 0.1611
Echinococcus multilocularis jumonji domain containing protein 0.0037 0.0014 0.0012
Loa Loa (eye worm) PHD-finger family protein 0.0027 0.0006 0.0029
Brugia malayi RNA binding protein 0.0142 0.0092 0.0565
Loa Loa (eye worm) hypothetical protein 0.0021 0.0002 0.0001
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.2163 0.1613 0.1611
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.003 0.0009 0.0046
Plasmodium vivax hypothetical protein, conserved 0.0027 0.0006 0.0058
Toxoplasma gondii aldose reductase, putative 0.2163 0.1613 1
Echinococcus multilocularis peregrin 0.0027 0.0006 0.0004
Schistosoma mansoni hypothetical protein 0.0247 0.0172 0.1057
Loa Loa (eye worm) jmjC domain-containing protein 0.0055 0.0027 0.0161
Echinococcus granulosus aldo keto reductase 0.2163 0.1613 0.1611
Echinococcus granulosus aldo keto reductase family 1, member B4 0.0627 0.0457 0.0455
Echinococcus multilocularis snurportin 1 0.0247 0.0172 0.017
Schistosoma mansoni sex comb on midleg homolog 0.0033 0.0011 0.0057
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0071 0.0039 0.0037
Brugia malayi glutamate-cysteine ligase modifier subunit 0.0627 0.0457 0.2828
Leishmania major cytochrome p450-like protein 0.0021 0.0001 0.0008
Trichomonas vaginalis aldo/keto reductase, putative 0.2163 0.1613 1
Mycobacterium ulcerans thymidine phosphorylase 1.3313 1 1
Toxoplasma gondii exonuclease III APE 0.0049 0.0022 0.0119
Mycobacterium tuberculosis Probable anthranilate phosphoribosyltransferase TrpD 0.3758 0.2812 0.2796
Mycobacterium tuberculosis Probable oxidoreductase 0.2163 0.1613 0.1594
Loa Loa (eye worm) hypothetical protein 0.0033 0.0011 0.0058
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0049 0.0022 0.0139
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.2163 0.1613 1
Brugia malayi jmjC domain containing protein 0.0032 0.001 0.0055
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0432 0.0311 0.0309
Schistosoma mansoni tar DNA-binding protein 0.0142 0.0092 0.0564
Echinococcus granulosus importin subunit beta 1 0.0023 0.0003 0.0001
Schistosoma mansoni hypothetical protein 0.0021 0.0002 0.0003
Trichomonas vaginalis aldo-keto reductase, putative 0.2163 0.1613 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0627 0.0457 0.2834
Leishmania major hypothetical protein, conserved 0.0048 0.0022 0.0135
Onchocerca volvulus 0.0627 0.0457 0.2808
Toxoplasma gondii PHD-finger domain-containing protein 0.0027 0.0006 0.0016
Leishmania major prostaglandin f synthase, putative 0.2163 0.1613 1
Echinococcus granulosus aldo keto reductase 0.2163 0.1613 0.1611
Trichomonas vaginalis aldo-keto reductase, putative 0.2163 0.1613 1
Mycobacterium ulcerans anthranilate phosphoribosyltransferase 0.3758 0.2812 0.2812
Trypanosoma brucei prostaglandin f synthase 0.2163 0.1613 1
Echinococcus multilocularis thymidine phosphorylase 1.3313 1 1
Loa Loa (eye worm) oxidoreductase 0.2163 0.1613 1
Echinococcus granulosus aldo keto reductase 0.2163 0.1613 0.1611
Echinococcus granulosus aldehyde reductase 0.1537 0.1142 0.114
Trichomonas vaginalis aldo-keto reductase, putative 0.2163 0.1613 1
Echinococcus multilocularis aldo keto reductase 0.2163 0.1613 0.1611
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0049 0.0022 0.002
Echinococcus granulosus hypothetical protein 0.2163 0.1613 0.1611
Brugia malayi exodeoxyribonuclease III family protein 0.0049 0.0022 0.0131
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.2163 0.1613 1
Trichomonas vaginalis aldo-keto reductase, putative 0.2163 0.1613 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.2163 0.1613 0.1611
Schistosoma mansoni tar DNA-binding protein 0.0142 0.0092 0.0564
Brugia malayi RNA, U transporter 1 0.0066 0.0035 0.0212
Echinococcus multilocularis aldehyde reductase 0.1537 0.1142 0.114
Loa Loa (eye worm) oxidoreductase 0.2163 0.1613 1
Mycobacterium leprae PROBABLE OXIDOREDUCTASE 0.2163 0.1613 0.4907
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0049 0.0022 0.0139
Trypanosoma brucei importin beta-1 subunit, putative 0.0023 0.0003 0.0012
Brugia malayi RNA recognition motif domain containing protein 0.0142 0.0092 0.0565
Loa Loa (eye worm) mbt repeat family protein 0.0033 0.0011 0.0058
Schistosoma mansoni pol-related 0.2163 0.1613 1
Echinococcus granulosus PHD finger protein rhinoceros 0.0027 0.0006 0.0004
Schistosoma mansoni aldo-keto reductase 0.2163 0.1613 1
Brugia malayi Importin beta-1 subunit 0.0023 0.0003 0.0012
Leishmania major aldo/keto reductase, putative,aldo/keto reductase family-like protein 0.0627 0.0457 0.2834
Loa Loa (eye worm) hypothetical protein 0.0038 0.0014 0.008
Echinococcus multilocularis histone acetyltransferase MYST2 0.0038 0.0014 0.0012
Echinococcus granulosus peregrin 0.0027 0.0006 0.0004
Echinococcus granulosus lysine specific demethylase 5A 0.0032 0.001 0.0008
Trichomonas vaginalis aldo-keto reductase, putative 0.2163 0.1613 1
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0049 0.0022 0.0422
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0049 0.0022 0.0422
Loa Loa (eye worm) cytochrome P450 family protein 0.0043 0.0018 0.0106
Loa Loa (eye worm) oxidoreductase 0.2163 0.1613 1
Trichomonas vaginalis ap endonuclease, putative 0.0049 0.0022 0.0139
Trichomonas vaginalis conserved hypothetical protein 0.0627 0.0457 0.2834
Schistosoma mansoni tar DNA-binding protein 0.0142 0.0092 0.0564
Trypanosoma cruzi PAB1-binding protein , putative 0.0048 0.0022 0.0135
Loa Loa (eye worm) jmjC domain-containing protein 0.0032 0.001 0.0055
Schistosoma mansoni sex comb on midleg homolog 0.0033 0.0011 0.0057
Echinococcus granulosus histone acetyltransferase MYST2 0.0038 0.0014 0.0012
Loa Loa (eye worm) glutamate-cysteine ligase modifier subunit 0.0627 0.0457 0.2828
Onchocerca volvulus 0.2163 0.1613 1
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0049 0.0022 0.0021
Entamoeba histolytica aldose reductase, putative 0.2163 0.1613 1
Entamoeba histolytica alcohol dehydrogenase, putative 0.0627 0.0457 0.2834
Plasmodium falciparum ataxin-2 like protein, putative 0.0048 0.0022 0.0406
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0027 0.0006 0.0027
Trichomonas vaginalis aldo-keto reductase, putative 0.2163 0.1613 1
Echinococcus granulosus tar DNA binding protein 0.0142 0.0092 0.009
Trichomonas vaginalis ap endonuclease, putative 0.0049 0.0022 0.0139
Schistosoma mansoni tar DNA-binding protein 0.0142 0.0092 0.0564
Trichomonas vaginalis aldo-keto reductase, putative 0.2163 0.1613 1
Schistosoma mansoni potassium channel beta 0.0627 0.0457 0.2828
Schistosoma mansoni importin beta-1 0.0023 0.0003 0.0011
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0247 0.0172 0.1059
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0071 0.0039 0.0037
Toxoplasma gondii oxidoreductase, aldo/keto reductase family protein 0.0627 0.0457 0.282
Brugia malayi hypothetical protein 0.0048 0.0022 0.0127
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0038 0.0014 0.0012
Trichomonas vaginalis aldo/keto reductase, putative 0.2163 0.1613 1
Echinococcus multilocularis polycomb protein SCMH1 0.0033 0.0011 0.0009
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.2163 0.1613 0.1611
Schistosoma mansoni aldo-keto reductase 0.2163 0.1613 1
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0071 0.0039 0.0235
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0049 0.0022 0.0131
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.2163 0.1613 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0071 0.0039 0.0234
Schistosoma mansoni hypothetical protein 0.021 0.0144 0.0885
Giardia lamblia Aldose reductase 0.2163 0.1613 1
Schistosoma mansoni hypothetical protein 0.0083 0.0049 0.0292
Echinococcus multilocularis voltage gated potassium channel subunit 0.0627 0.0457 0.0455
Echinococcus multilocularis PHD finger protein rhinoceros 0.0027 0.0006 0.0004
Plasmodium vivax ataxin-2 like protein, putative 0.0048 0.0022 0.0406
Mycobacterium ulcerans hypothetical protein 0.0627 0.0457 0.0456
Echinococcus multilocularis geminin 0.0083 0.0049 0.0047
Loa Loa (eye worm) hypothetical protein 0.0046 0.002 0.0118
Echinococcus multilocularis SAM and MBT domain containing protein 0.0033 0.0011 0.0009
Onchocerca volvulus 0.0033 0.0011 0.003
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0049 0.0022 0.002
Trypanosoma cruzi PAB1-binding protein , putative 0.0048 0.0022 0.0135
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0071 0.0039 0.0235
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.2163 0.1613 1
Brugia malayi latrophilin 2 splice variant baaae 0.0021 0.0002 0.0001
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.2163 0.1613 0.1611
Trypanosoma brucei aldo/keto reductase, putative 0.0627 0.0457 0.2828
Trichomonas vaginalis aldo/keto reductase, putative 0.2163 0.1613 1
Loa Loa (eye worm) oxidoreductase 0.2163 0.1613 1
Trypanosoma cruzi aldo/keto reductase, putative 0.0627 0.0457 0.2834
Echinococcus multilocularis tar DNA binding protein 0.0142 0.0092 0.009
Toxoplasma gondii aldo-keto reductase 0.0627 0.0457 0.282
Echinococcus granulosus aldo keto reductase family 1 member B4 0.2163 0.1613 0.1611
Echinococcus granulosus polycomb protein SCMH1 0.0033 0.0011 0.0009
Leishmania major aldo-keto reductase-like protein 0.2163 0.1613 1
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0049 0.0022 0.0139
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0038 0.0014 0.0012
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.2163 0.1613 0.1611
Onchocerca volvulus 0.2163 0.1613 1
Loa Loa (eye worm) hypothetical protein 0.0023 0.0003 0.0012
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.2163 0.1613 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0627 0.0457 0.2834
Trypanosoma cruzi cytochrome P450, putative 0.0021 0.0001 0.0008
Schistosoma mansoni ap endonuclease 0.0049 0.0022 0.013
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.2163 0.1613 1
Entamoeba histolytica aldose reductase, putative 0.2163 0.1613 1
Schistosoma mansoni hypothetical protein 0.0083 0.0049 0.0292
Loa Loa (eye worm) MBCTL1 0.0038 0.0014 0.008
Plasmodium vivax oxidoreductase, aldo/keto reductase domain containing protein 0.0627 0.0457 1
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0033 0.0011 0.0057
Trichomonas vaginalis aldo-keto reductase, putative 0.2163 0.1613 1
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0049 0.0022 0.0139
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.2163 0.1613 1
Plasmodium falciparum aldehyde reductase, putative 0.0627 0.0457 1
Schistosoma mansoni tar DNA-binding protein 0.0142 0.0092 0.0564
Echinococcus multilocularis aldo keto reductase 0.2163 0.1613 0.1611
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0049 0.0022 0.0131
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0049 0.0022 0.0103
Trichomonas vaginalis aldo-keto reductase, putative 0.2163 0.1613 1
Mycobacterium leprae Conserved hypothetical protein 0.1537 0.1142 0.2906
Schistosoma mansoni jumonji/arid domain-containing protein 0.0032 0.001 0.0054
Onchocerca volvulus 0.2163 0.1613 1
Trypanosoma cruzi cytochrome P450, putative 0.0021 0.0001 0.0008
Loa Loa (eye worm) hypothetical protein 0.0048 0.0022 0.0127
Brugia malayi jmjC domain containing protein 0.0087 0.0052 0.0312
Plasmodium vivax aldehyde reductase, putative 0.0627 0.0457 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.2163 0.1613 0.1611
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0142 0.0092 0.0565
Loa Loa (eye worm) TAR-binding protein 0.0142 0.0092 0.0565
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0087 0.0052 0.005
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.2163 0.1613 0.1611
Brugia malayi Cytochrome P450 family protein 0.0043 0.0018 0.0106
Entamoeba histolytica aldose reductase, putative 0.2163 0.1613 1
Toxoplasma gondii aldo/keto reductase family oxidoreductase 0.0627 0.0457 0.282
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.2163 0.1613 0.1611
Echinococcus granulosus voltage gated potassium channel subunit 0.0627 0.0457 0.0455
Schistosoma mansoni ap endonuclease 0.0049 0.0022 0.013
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0071 0.0039 0.0037
Schistosoma mansoni hypothetical protein 0.0027 0.0006 0.0027
Plasmodium falciparum ataxin-2 like protein, putative 0.0048 0.0022 0.0406
Echinococcus granulosus aldo keto reductase family 1 member B4 0.2163 0.1613 0.1611
Echinococcus granulosus geminin 0.0083 0.0049 0.0047
Loa Loa (eye worm) pigment dispersing factor receptor c 0.003 0.0009 0.0046
Trichomonas vaginalis aldo-keto reductase, putative 0.2163 0.1613 1
Entamoeba histolytica alcohol dehydrogenase, putative 0.0627 0.0457 0.2834
Brugia malayi Bromodomain containing protein 0.0027 0.0006 0.0029
Echinococcus granulosus jumonji domain containing protein 0.0037 0.0014 0.0012
Plasmodium falciparum aldo-keto reductase, putative 0.0627 0.0457 1
Echinococcus granulosus SAM and MBT domain containing protein 0.0033 0.0011 0.0009
Trichomonas vaginalis aldo-keto reductase, putative 0.2163 0.1613 1
Echinococcus multilocularis aldo keto reductase 0.2163 0.1613 0.1611
Echinococcus granulosus aldo keto reductase family 1 member B4 0.2163 0.1613 0.1611
Schistosoma mansoni myelin transcription factor 1 myt1 0.0038 0.0014 0.0078
Echinococcus granulosus aldo keto reductase family 1 member B4 0.2163 0.1613 0.1611
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0033 0.0011 0.003
Toxoplasma gondii PHD-finger domain-containing protein 0.0027 0.0006 0.0016
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0071 0.0039 0.0234
Echinococcus multilocularis importin subunit beta 1 0.0023 0.0003 0.0001
Echinococcus granulosus aldo keto reductase family 1 member B4 0.2163 0.1613 0.1611
Brugia malayi hypothetical protein 0.0031 0.0009 0.0048
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.2163 0.1613 0.1611
Echinococcus multilocularis lysine specific demethylase 5A 0.0032 0.001 0.0008
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.014 0.0091 0.0089
Brugia malayi NADH-dependent xylose reductase 0.0627 0.0457 0.2828

Activities

Activity type Activity value Assay description Source Reference
Ki (binding) = -7.48 Binding affinity to CB2 receptor (unknown origin) ChEMBL. 17521177
Ki (binding) = -6.18 Binding affinity at CB1 receptor ChEMBL. 17980589
Ki (binding) = -6.18 Binding affinity to CB1 receptor (unknown origin) ChEMBL. 17521177
Ki (binding) = 32.87 nM Binding affinity to CB2 receptor (unknown origin) ChEMBL. 17521177
Ki (binding) = 32.87 nM Binding affinity to CB2 receptor (unknown origin) ChEMBL. 17521177
Ki (binding) = 666.4 nM Binding affinity to CB1 receptor (unknown origin) ChEMBL. 17521177
Ki (binding) = 666.4 nM Binding affinity to CB1 receptor (unknown origin) ChEMBL. 17521177
Log Ki (binding) = 6.18 Binding affinity at CB1 receptor ChEMBL. 17980589
Log Ki (binding) = 6.18 Binding affinity to CB1 receptor (unknown origin) ChEMBL. 17521177
Log Ki (binding) = 7.48 Binding affinity to CB2 receptor (unknown origin) ChEMBL. 17521177

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

Bibliographic References

2 literature references were collected for this gene.

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