Natural Product: NPC78359

Natural Product ID:  NPC78359
Common Name:   Galantamine
IUPAC Name:  
Synonyms:   Acumor XL; Consion XL; Elmino XL; Galantamine; Galanthamine; Galsya XL; Galzemic XL; Gatalin XL; Gazylan XL; Lotprosin XL; Luventa XL; Razadyne; Reminyl; Reminyl XL; Zeebral XL
Molecular Formula:   C17H21NO3
Standard InCHIKey:  ASUTZQLVASHGKV-JDFRZJQESA-N
Standard InCHI:  InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1
Canonical SMILES:  COc1ccc2c3c1O[C@@H]1[C@@]3(CCN(C2)C)C=C[C@@H](C1)O
First Find Year:  
Max Developmental Stage:  
Synthetic Gene Cluster:   ;

  Species Source

Organism ID Organism Name Taxonomy Level Family SuperKingdom Isolation Part Collection Location Collection Time Reference
NPO13480 Stereocaulon dactylophyllum Species Stereocaulaceae Eukaryota UNPD*
NPO26299 Reticularia lycoperdon Species Reticulariaceae Eukaryota UNPD*
NPO19776 Hesperocyparis arizonica Species Cupressaceae Eukaryota UNPD*
NPO3630 Crotalaria crispata Species Fabaceae Eukaryota UNPD*
NPO9485 Haplopappus deserticola Species Asteraceae Eukaryota UNPD*
NPO23091 Halocarpus bidwillii Species Podocarpaceae Eukaryota UNPD*
NPO17378 Percis semifasciata Species Agonidae Eukaryota UNPD*
NPO18449 Salvia yunnanensis Species Lamiaceae Eukaryota UNPD*
NPO26604 Aralia subcapitata Species Araliaceae Eukaryota UNPD*
NPO17432 Ligularia przewalskii Species Asteraceae Eukaryota UNPD*
NPO1412 Artemisia juncea Species Asteraceae Eukaryota UNPD*
NPO13259 Commiphora wightii Species Burseraceae Eukaryota UNPD*
NPO14727 Streptomyces phaeochromogenes Species Streptomycetaceae Bacteria UNPD*
NPO13181 Ferula persica Species Apiaceae Eukaryota UNPD*
NPO272 Pittosporum eugenioides Species Pittosporaceae Eukaryota UNPD*
NPO19610 Stachys aegyptiaca Species Lamiaceae Eukaryota UNPD*
NPO25694 Leucojum aestivum Species Amaryllidaceae Eukaryota PMID[18356045]
NPO33437 amaryllidaceae Family Amaryllidaceae Eukaryota PMID[22921081]
NPO13120 Pancratium maritimum Species Amaryllidaceae Eukaryota Turkey PMID[19299148]
NPO25694 Leucojum aestivum Species Amaryllidaceae Eukaryota Turkey PMID[19299148]
NPO17954 Narcissus tazetta Species Amaryllidaceae Eukaryota Turkey PMID[19299148]
NPO26154 Erythropodium caribaeorum Species Anthothelidae Eukaryota UNPD*
NPO9927 Crinum asiaticum Species Amaryllidaceae Eukaryota UNPD*
NPO26641 Pteroxygonum giraldii Species Polygonaceae Eukaryota UNPD*
NPO24293 Neorautanenia mitis Species Fabaceae Eukaryota UNPD*
NPO21398 Jasminum laurifolium f. nitidum Species Oleaceae Eukaryota UNPD*
NPO17956 Fagus glauca Species Fagaceae Eukaryota UNPD*
NPO14342 Chrysobalanus icaco Species Chrysobalanaceae Eukaryota UNPD*
NPO389 Actaea heracleifolia Species Ranunculaceae Eukaryota UNPD*
NPO9144 Atriplex parvifolia Species Chenopodiaceae Eukaryota UNPD*
NPO17715 Flindersia bourjotiana Species Rutaceae Eukaryota UNPD*
NPO11000 Eupatorium laevigatum Species Asteraceae Eukaryota UNPD*
NPO11473 Viburnum lantana Species Adoxaceae Eukaryota UNPD*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 35000 nM 12824041
NPT439 Individual Protein Butyrylcholinesterase Homo sapiens IC50 = 18000 nM 12824041
NPT2749 Individual Protein Acetylcholinesterase Rattus norvegicus IC50 = 1030000 nM 10.1016/S0960-894X(01)81154-9
NPT2749 Individual Protein Acetylcholinesterase Rattus norvegicus IC50 = 538 nM 7636858
NPT2749 Individual Protein Acetylcholinesterase Rattus norvegicus IC50 = 750 nM 8126709
NPT2749 Individual Protein Acetylcholinesterase Rattus norvegicus ID50 > 30 mg/kg 8126709
NPT32 Organism Mus musculus Mus musculus ED50 = 5 mg/kg 8126709
NPT32 Organism Mus musculus Mus musculus ED50 = 3 mg/kg 8126709
NPT32 Organism Mus musculus Mus musculus LD50 = 10 mg/kg 8126709
NPT2668 Individual Protein Acetylcholinesterase Torpedo californica IC50 = 360 nM 12729674
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 360 nM 10762042
NPT2749 Individual Protein Acetylcholinesterase Rattus norvegicus IC50 = 630 nM 7658452
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 800 nM 12166941
NPT439 Individual Protein Butyrylcholinesterase Homo sapiens IC50 = 7300 nM 12166941
NPT2749 Individual Protein Acetylcholinesterase Rattus norvegicus IC50 = 1760 nM 10.1016/0960-894X(96)00102-3
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 100 nM 10.1016/0960-894X(96)00102-3
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 ~ 500 nM 12182861
NPT204 Individual Protein Acetylcholinesterase Homo sapiens EC50 = 1100 nM 12182861
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 800 nM 15715468
NPT439 Individual Protein Butyrylcholinesterase Homo sapiens IC50 = 7300 nM 15715468
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus Ki = 1560 nM 16366609
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 2200 nM 16366609
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 500 nM 16274989
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus Ki = 440 nM 16274989
NPT2569 Individual Protein Butyrylcholinesterase Equus caballus IC50 = 8500 nM 16274989
NPT2569 Individual Protein Butyrylcholinesterase Equus caballus Ki = 8000 nM 16274989
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 800 nM 16570913
NPT439 Individual Protein Butyrylcholinesterase Homo sapiens IC50 = 7300 nM 16570913
NPT3768 Others Cholinesterases; ACHE & BCHE Homo sapiens Ratio IC50 = 9 16570913
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 590 nM 16483771
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 640 nM 16942014
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 635.33 nM 16942014
NPT2569 Individual Protein Butyrylcholinesterase Equus caballus IC50 = 8400 nM 16942014
NPT2569 Individual Protein Butyrylcholinesterase Equus caballus IC50 = 1.19E+14 nM 16942014
NPT2 Others Unspecified Ratio IC50 = 0.08 16942014
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 600 nM 16945529
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 635.33 nM 16945529
NPT439 Individual Protein Butyrylcholinesterase Homo sapiens IC50 = 8400 nM 16945529
NPT439 Individual Protein Butyrylcholinesterase Homo sapiens IC50 = 8394.6 nM 16945529
NPT2 Others Unspecified Ratio IC50 = 14 16945529
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 3200 nM 15566295
NPT29 Organism Rattus norvegicus Rattus norvegicus Activity = 1.78 15566295
NPT29 Organism Rattus norvegicus Rattus norvegicus Activity = 1.68 15566295
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 3180 nM 17085051
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 2010 nM 17850125
NPT439 Individual Protein Butyrylcholinesterase Homo sapiens IC50 = 20700 nM 17850125
NPT78 Individual Protein Beta amyloid A4 protein Homo sapiens Inhibition < 5 % 17850125
NPT204 Individual Protein Acetylcholinesterase Homo sapiens Inhibition = 17.9 % 17850125
NPT2 Others Unspecified Ratio IC50 = 27.7 17317172
NPT2569 Individual Protein Butyrylcholinesterase Equus caballus IC50 = 15240 nM 17317172
NPT2668 Individual Protein Acetylcholinesterase Torpedo californica IC50 = 550 nM 17317172
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 360 nM 17902635
NPT439 Individual Protein Butyrylcholinesterase Homo sapiens IC50 > 10000 nM 17902635
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 550 nM 17451950
NPT2569 Individual Protein Butyrylcholinesterase Equus caballus IC50 = 14400 nM 17451950
NPT2 Others Unspecified Ratio IC50 = 26 17451950
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 1070 nM 17822295
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 1820 nM 18356045
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 980 nM 10869205
NPT204 Individual Protein Acetylcholinesterase Homo sapiens Inhibition = 96.82 % 18336006
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 640 nM 18343673
NPT2569 Individual Protein Butyrylcholinesterase Equus caballus IC50 = 8400 nM 18343673
NPT2569 Individual Protein Butyrylcholinesterase Equus caballus IC50 = 8394.6 nM 18343673
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 635.33 nM 18343673
NPT2 Others Unspecified Ratio IC50 = 0.08 18343673
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 500 nM 18681480
NPT439 Individual Protein Butyrylcholinesterase Homo sapiens IC50 = 8500 nM 18681480
NPT2668 Individual Protein Acetylcholinesterase Torpedo californica IC50 = 652 nM 18479118
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 350 nM 18479118
NPT439 Individual Protein Butyrylcholinesterase Homo sapiens IC50 = 18600000 nM 18479118
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 2010 nM 18954037
NPT439 Individual Protein Butyrylcholinesterase Homo sapiens IC50 = 20700 nM 18954037
NPT204 Individual Protein Acetylcholinesterase Homo sapiens Inhibition = 17.9 % 18954037
NPT78 Individual Protein Beta amyloid A4 protein Homo sapiens Inhibition < 5 % 18954037
NPT2749 Individual Protein Acetylcholinesterase Rattus norvegicus IC50 = 1165 nM 18550228
NPT2748 Individual Protein Butyrylcholinesterase Rattus norvegicus IC50 = 5900 nM 18550228
NPT2 Others Unspecified Ratio IC50 = 5.06 18550228
NPT2749 Individual Protein Acetylcholinesterase Rattus norvegicus IC50 = 920 nM 15568781
NPT2668 Individual Protein Acetylcholinesterase Torpedo californica IC50 = 590 nM 18538575
NPT204 Individual Protein Acetylcholinesterase Homo sapiens Inhibition = 99.7 % 12398535
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 3200 nM 16989531
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 1180 nM 16989531
NPT204 Individual Protein Acetylcholinesterase Homo sapiens Inhibition = 97.66 % 16989531
NPT204 Individual Protein Acetylcholinesterase Homo sapiens Activity = 0.01 ug 16724838
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 500 nM 18650096
NPT439 Individual Protein Butyrylcholinesterase Homo sapiens IC50 = 8000 nM 18650096
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 14400 nM 19243862
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 550 nM 19243862
NPT2 Others Unspecified Ratio IC50 = 26 19243862
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 73900 nM 19215141
NPT439 Individual Protein Butyrylcholinesterase Homo sapiens IC50 = 50900 nM 19215141
NPT204 Individual Protein Acetylcholinesterase Homo sapiens MIC = 0.01 ug 19007183
NPT632 Tissue Brain Rattus norvegicus EC50 = 4.93 ug/ml 19853328
NPT632 Tissue Brain Rattus norvegicus EC50 = 4.21 ug/ml 19853328
NPT2 Others Unspecified EC50 = 3.84 ug/ml 19853328
NPT3928 Individual Protein Catalase Rattus norvegicus EC50 = 5.06 ug/ml 19853328
NPT632 Tissue Brain Rattus norvegicus Activity = 29.37 ug/ml 19853328
NPT632 Tissue Brain Rattus norvegicus Activity = 283.44 ug/ml 19853328
NPT632 Tissue Brain Rattus norvegicus Activity = 70.68 ug/ml 19853328
NPT632 Tissue Brain Rattus norvegicus Activity = 4.69 ug/ml 19853328
NPT173 Organism Klebsiella pneumoniae Klebsiella pneumoniae IZ = 1.83 mm 19853328
NPT16 Organism Staphylococcus aureus Staphylococcus aureus IZ = 1.75 mm 19853328
NPT79 Organism Bacillus subtilis Bacillus subtilis IZ = 2.73 mm 19853328
NPT19 Organism Escherichia coli Escherichia coli IZ = 1.62 mm 19853328
NPT173 Organism Klebsiella pneumoniae Klebsiella pneumoniae IZ = 2.21 mm 19853328
NPT16 Organism Staphylococcus aureus Staphylococcus aureus IZ = 2.66 mm 19853328
NPT79 Organism Bacillus subtilis Bacillus subtilis IZ = 2.25 mm 19853328
NPT19 Organism Escherichia coli Escherichia coli IZ = 2.02 mm 19853328
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 1 ug/ml 19853328
NPT173 Organism Klebsiella pneumoniae Klebsiella pneumoniae MIC = 0.62 ug/ml 19853328
NPT79 Organism Bacillus subtilis Bacillus subtilis MIC = 0.18 ug/ml 19853328
NPT19 Organism Escherichia coli Escherichia coli MIC = 0.7 ug/ml 19853328
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 2100 nM 20025280
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 623 nM 20056426
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 15700 nM 20056426
NPT2 Others Unspecified Ratio IC50 = 25.3 20056426
NPT914 Individual Protein Acetylcholinesterase Bos taurus IC50 = 8700 nM 20176490
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 24400 nM 20176490
NPT2 Others Unspecified Ratio IC50 = 2.8 20176490
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 640 nM 20350808
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 635.33 nM 20350808
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 8400 nM 20350808
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 8394.6 nM 20350808
NPT2 Others Unspecified Ratio IC50 = 0.08 20350808
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 8394.6 nM 20361801
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 635.33 nM 20361801
NPT3929 Protein Complex Glutamate NMDA receptor; GRIN1/GRIN2A Homo sapiens Activity = 96.8 % 20361801
NPT3930 Protein Complex Glutamate NMDA receptor; GRIN1/GRIN2B Homo sapiens Activity = 93.7 % 20361801
NPT2 Others Unspecified Ratio IC50 = 13.2 20361801
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 636 nM 20361801
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 8404 nM 20361801
NPT2 Others Unspecified MIC = 0.003 nM 20415428
NPT2 Others Unspecified IC50 = 21400 nM 20575555
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 12000 nM 20575555
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 560 nM 20575555
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 600 nM 20575555
NPT519 Cell Line SH-SY5Y Homo sapiens Activity = 0 % 20575555
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 623 nM 20471843
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 15700 nM 20471843
NPT2 Others Unspecified Ratio IC50 = 25.3 20471843
NPT485 Organism Plasmodium falciparum (isolate K1 / Thailand) Plasmodium falciparum K1 IC50 = 4.38 ug/ml 19299148
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus Ki = 428 nM 20656495
NPT204 Individual Protein Acetylcholinesterase Homo sapiens Ki = 300 nM 20655219
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 3200 nM 20580236
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 3200 nM 20850311
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 2000 nM 20828184
NPT483 Individual Protein Prelamin-A/C Homo sapiens Potency = 35481.3 nM PubChem BioAssay data set
NPT94 Individual Protein Aldehyde dehydrogenase 1A1 Homo sapiens Potency = 15848.9 nM PubChem BioAssay data set
NPT204 Individual Protein Acetylcholinesterase Homo sapiens MIC = 0.001 ug 21049906
NPT204 Individual Protein Acetylcholinesterase Homo sapiens MIC = 0.003 nM 21049906
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 530 nM 20954721
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 3200 nM 20964319
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 640 nM 21232964
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 635.33 nM 21232964
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 8400 nM 21232964
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 8394.6 nM 21232964
NPT2 Others Unspecified Ratio IC50 = 0.08 21232964
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 2600 nM 21189039
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 623 nM 21397508
NPT2569 Individual Protein Butyrylcholinesterase Equus caballus IC50 = 15700 nM 21397508
NPT2 Others Unspecified Ratio IC50 = 25.3 21397508
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 350 nM 21216144
NPT439 Individual Protein Butyrylcholinesterase Homo sapiens IC50 = 18600 nM 21216144
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 800 nM 21459491
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 7300 nM 21459491
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus Inhibition = 6.197 % 21546135
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 640 nM 21546135
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 8400 nM 21546135
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 8394.6 nM 21546135
NPT204 Individual Protein Acetylcholinesterase Homo sapiens MIC = 0.001 ug 21126060
NPT198 Individual Protein Vitamin D receptor Homo sapiens Potency 89125.1 nM PubChem BioAssay data set
NPT6 Organism Plasmodium falciparum Plasmodium falciparum Potency 19011.5 nM PubChem BioAssay data set
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 1156 nM DrugMatrix in vitro pharmacology data
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 623 nM 22041172
NPT2569 Individual Protein Butyrylcholinesterase Equus caballus IC50 = 15700 nM 22041172
NPT2 Others Unspecified Ratio IC50 = 25.3 22041172
NPT519 Cell Line SH-SY5Y Homo sapiens Activity = 36 % 21420206
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 600 nM 22425563
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus Inhibition = 100 % 22425563
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 300 nM 22425563
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 623 nM 22633691
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 15700 nM 22633691
NPT2 Others Unspecified Ratio IC50 = 25.3 22633691
NPT2 Others Unspecified Ratio IC50 = 0.3 22704921
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 12600 nM 22704921
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 3200 nM 22704921
NPT2 Others Unspecified Inhibition = 48 % 22704921
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 1000 nM 22775474
NPT1160 Cell Line BJ Homo sapiens IC50 > 50000 nM 22921081
NPT2468 Cell Line G-361 Homo sapiens IC50 > 50000 nM 22921081
NPT165 Cell Line HeLa Homo sapiens IC50 > 50000 nM 22921081
NPT83 Cell Line MCF7 Homo sapiens IC50 > 50000 nM 22921081
NPT111 Cell Line K562 Homo sapiens IC50 > 50000 nM 22921081
NPT404 Cell Line CCRF-CEM Homo sapiens IC50 > 50000 nM 22921081
NPT2 Others Unspecified Ratio = 11.48 23041347
NPT2 Others Unspecified Ratio Ki = 3.1 23041347
NPT439 Individual Protein Butyrylcholinesterase Homo sapiens Ki = 192.47 nM 23041347
NPT204 Individual Protein Acetylcholinesterase Homo sapiens Ki = 61.96 nM 23041347
NPT519 Cell Line SH-SY5Y Homo sapiens IC50 = 747 nM 23033965
NPT3933 Individual Protein Glutamate [NMDA] receptor subunit epsilon 2 Rattus norvegicus Ki > 100000 nM 23033965
NPT2 Others Unspecified Ki > 10000 nM 23033965
NPT2749 Individual Protein Acetylcholinesterase Rattus norvegicus IC50 = 2550 nM 23033965
NPT2 Others Unspecified Ratio IC50 = 0.08 22624880
NPT439 Individual Protein Butyrylcholinesterase Homo sapiens IC50 = 8000 nM 10.1007/s00044-011-9754-6
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 500 nM 10.1007/s00044-011-9754-6
NPT439 Individual Protein Butyrylcholinesterase Homo sapiens IC50 = 170 nM 10.1007/s00044-011-9804-0
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 500 nM 10.1007/s00044-011-9804-0
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus Inhibition = 0.6 % 10.1007/s00044-008-9122-3
NPT439 Individual Protein Butyrylcholinesterase Homo sapiens IC50 = 7000 nM 23199476
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 300 nM 23199476
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus Ki = 1060 nM 23330848
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 7440 nM 23330848
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 7960 nM 23462716
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 4000 nM 23462716
NPT2 Others Unspecified Ratio IC50 = 0.28 23454132
NPT2 Others Unspecified Ratio IC50 = 3.47 23454132
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 19340 nM 23454132
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 2090 nM 23454132
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 19340 nM 23570788
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 2090 nM 23570788
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 1450 nM 23583510
NPT439 Individual Protein Butyrylcholinesterase Homo sapiens IC50 = 10000 nM 23540646
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 2000 nM 23540646
NPT2 Others Unspecified Ratio IC50 = 0.28 23602518
NPT2 Others Unspecified Ratio IC50 = 3.47 23602518
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 19340 nM 23602518
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 2090 nM 23602518
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 12700 nM 23511019
NPT2 Others Unspecified Ratio IC50 = 4.8 23511019
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 2670 nM 23511019
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 12700 nM 23685572
NPT2 Others Unspecified Ratio IC50 = 4.76 23685572
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 2670 nM 23685572
NPT2 Others Unspecified Ratio IC50 = 0.11 23871902
NPT2 Others Unspecified Ratio IC50 = 9.25 23871902
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 19340 nM 23871902
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 2090 nM 23871902
NPT2 Others Unspecified Ratio IC50 = 4.76 24095756
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 12700 nM 24095756
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 2670 nM 24095756
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 2010 nM 23984975
NPT2 Others Unspecified Ratio IC50 = 0.28 24369842
NPT2 Others Unspecified Ratio IC50 = 3.47 24369842
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 19340 nM 24369842
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 2090 nM 24369842
NPT3902 Individual Protein Acetylcholinesterase Mus musculus IC50 = 2500 nM 24485122
NPT3902 Individual Protein Acetylcholinesterase Mus musculus Inhibition = 91.94 % 24485122
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 3200 nM 24485122
NPT2 Others Unspecified Ratio IC50 = 0.28 24461561
NPT2 Others Unspecified Ratio IC50 = 3.47 24461561
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 19340 nM 24461561
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 2090 nM 24461561
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 2400 nM 24521095
NPT2 Others Unspecified Ratio IC50 = 0.27 24594525
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 10530 nM 24594525
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 39030 nM 24594525
NPT2 Others Unspecified Ratio IC50 = 5.1 24508831
NPT439 Individual Protein Butyrylcholinesterase Homo sapiens IC50 = 15800 nM 24508831
NPT2 Others Unspecified IC50 = 3120 nM 24508831
NPT2 Others Unspecified Activity = 71.7 % 24581918
NPT2 Others Unspecified Activity = 54.4 % 24581918
NPT2 Others Unspecified Activity = 57.1 % 24581918
NPT2 Others Unspecified Activity = 64.1 % 24581918
NPT2 Others Unspecified Activity = 65.9 % 24581918
NPT2 Others Unspecified Activity = 63.5 % 24581918
NPT2 Others Unspecified Activity = 65.3 % 24581918
NPT2 Others Unspecified Activity = 66.5 % 24581918
NPT2 Others Unspecified Activity = 65.4 % 24581918
NPT2 Others Unspecified Ratio IC50 = 4.91 10.1039/C3MD00376K
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 13610 nM 10.1039/C3MD00376K
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 2770 nM 10.1039/C3MD00376K
NPT2 Others Unspecified Potency 23710.1 nM PubChem BioAssay data set
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 550 nM 24606395
NPT204 Individual Protein Acetylcholinesterase Homo sapiens MIC = 0.004 ug 24673187
NPT204 Individual Protein Acetylcholinesterase Homo sapiens Inhibition = 61.44 % 24673187
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 1100 nM 24704612
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 2090 nM 24594354
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 19340 nM 24594354
NPT2 Others Unspecified Ratio IC50 = 3.47 24594354
NPT2 Others Unspecified Ratio IC50 = 0.28 24594354
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 2670 nM 24726809
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 12700 nM 24726809
NPT2 Others Unspecified Ratio IC50 = 2.76 24726809
NPT2 Others Unspecified IC50 = 8000 nM 24780600
NPT3902 Individual Protein Acetylcholinesterase Mus musculus IC50 = 2080 nM 25468034
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 2000 nM 25537270
NPT204 Individual Protein Acetylcholinesterase Homo sapiens Inhibition = 54 % 25537270
NPT439 Individual Protein Butyrylcholinesterase Homo sapiens Inhibition > 40 % 25537270
NPT204 Individual Protein Acetylcholinesterase Homo sapiens Ki = 61.9 nM 25088549
NPT439 Individual Protein Butyrylcholinesterase Homo sapiens Ki = 192.5 nM 25088549
NPT2 Others Unspecified Ratio Ki = 3.11 25088549
NPT439 Individual Protein Butyrylcholinesterase Homo sapiens IC50 = 12700 nM 24934993
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 2670 nM 24934993
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 700 nM 25189690
NPT439 Individual Protein Butyrylcholinesterase Homo sapiens IC50 = 21900 nM 25189690
NPT2 Others Unspecified Ratio IC50 = 31 25189690
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 2670 nM 25282654
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 12700 nM 25282654
NPT2 Others Unspecified Ratio IC50 = 4.76 25282654
NPT439 Individual Protein Butyrylcholinesterase Homo sapiens IC50 = 0.38 ug/ml 25813159
NPT2 Others Unspecified AC50 710 nM PubChem BioAssay data set
NPT2 Others Unspecified AC50 562.3 nM PubChem BioAssay data set
NPT2 Others Unspecified AC50 501.2 nM PubChem BioAssay data set
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 4000 nM 26030662
NPT204 Individual Protein Acetylcholinesterase Homo sapiens Ki = 250 nM 25921269
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 90000 nM 26105711
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 2410 nM 26244990
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 17380 nM 26244990
NPT2 Others Unspecified Ratio IC50 = 7.21 26244990
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 350 nM 26159481
NPT2 Others Unspecified Ratio IC50 = 29.74 26588065
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 19780 nM 26588065
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 665 nM 26588065
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 8500 nM 26795115
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 28100 nM 26795115
NPT66 Individual Protein Acetylcholinesterase Electrophorus electricus IC50 = 0.45 ug/ml 26599534
NPT439 Individual Protein Butyrylcholinesterase Homo sapiens IC50 = 6.34 ug/ml 26599534
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 2010 nM 26735910
NPT439 Individual Protein Butyrylcholinesterase Homo sapiens IC50 = 66500 nM 10.1039/C5MD00274E
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 2600 nM 10.1039/C5MD00274E
NPT2 Others Unspecified Ratio IC50 = 0.04 10.1039/C5MD00274E
NPT67 Individual Protein Cholinesterase Equus caballus IC50 = 28300 nM 26995529
NPT204 Individual Protein Acetylcholinesterase Homo sapiens Inhibition = 90 % 26841168
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 300 nM 26841168
NPT439 Individual Protein Butyrylcholinesterase Homo sapiens Ki = 28290 nM 27492195

  Similar Natural Products in NPASS

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules. Tc lies between [0, 1] where '1' indicates the highest similarity. What is Tanimoto coefficient

●  The left chart: Distribution of similarity level between NPC78359 and all remaining natural products in the NPASS database.
●  The right table: Most similar natural products (Tc>=0.56 or Top200).

Similarity Score Similarity Level Natural Product ID
1.0 High Similarity NPC148014
1.0 High Similarity NPC65490
1.0 High Similarity NPC315707
1.0 High Similarity NPC40389
0.9733 High Similarity NPC18402
0.9732 High Similarity NPC129603
0.9605 High Similarity NPC293871
0.9605 High Similarity NPC124433
0.8812 High Similarity NPC284842
0.8634 High Similarity NPC124657
0.8544 High Similarity NPC147091
0.8544 High Similarity NPC323443
0.8544 High Similarity NPC180756
0.8519 High Similarity NPC476002
0.8462 Intermediate Similarity NPC274026
0.8438 Intermediate Similarity NPC92191
0.8438 Intermediate Similarity NPC59028
0.8415 Intermediate Similarity NPC83198
0.8415 Intermediate Similarity NPC204908
0.8385 Intermediate Similarity NPC249274
0.8313 Intermediate Similarity NPC477640
0.8313 Intermediate Similarity NPC225597
0.8313 Intermediate Similarity NPC470739
0.8303 Intermediate Similarity NPC82533
0.8303 Intermediate Similarity NPC266176
0.8303 Intermediate Similarity NPC290759
0.8303 Intermediate Similarity NPC158148
0.8303 Intermediate Similarity NPC475686
0.8303 Intermediate Similarity NPC58766
0.8284 Intermediate Similarity NPC244554
0.8272 Intermediate Similarity NPC97072
0.8272 Intermediate Similarity NPC215829
0.8272 Intermediate Similarity NPC205167
0.8269 Intermediate Similarity NPC476151
0.8263 Intermediate Similarity NPC152680
0.8263 Intermediate Similarity NPC232386
0.8263 Intermediate Similarity NPC190783
0.8253 Intermediate Similarity NPC474475
0.8239 Intermediate Similarity NPC133011
0.8239 Intermediate Similarity NPC82285
0.8214 Intermediate Similarity NPC49353
0.8166 Intermediate Similarity NPC474470
0.8165 Intermediate Similarity NPC103379
0.8165 Intermediate Similarity NPC477565
0.8155 Intermediate Similarity NPC2314
0.8144 Intermediate Similarity NPC75958
0.8141 Intermediate Similarity NPC185838
0.8141 Intermediate Similarity NPC130926
0.8133 Intermediate Similarity NPC100566
0.8133 Intermediate Similarity NPC150879
0.8092 Intermediate Similarity NPC301050
0.8092 Intermediate Similarity NPC131204
0.8075 Intermediate Similarity NPC475557
0.8061 Intermediate Similarity NPC320104
0.8054 Intermediate Similarity NPC160193
0.8049 Intermediate Similarity NPC4304
0.8038 Intermediate Similarity NPC179825
0.8038 Intermediate Similarity NPC191376
0.8038 Intermediate Similarity NPC321505
0.8036 Intermediate Similarity NPC329911
0.8036 Intermediate Similarity NPC311991
0.8025 Intermediate Similarity NPC78733
0.8024 Intermediate Similarity NPC181653
0.8024 Intermediate Similarity NPC190332
0.8024 Intermediate Similarity NPC252960
0.8023 Intermediate Similarity NPC305847
0.8012 Intermediate Similarity NPC15919
0.8 Intermediate Similarity NPC187678
0.8 Intermediate Similarity NPC60186
0.7989 Intermediate Similarity NPC9867
0.7988 Intermediate Similarity NPC476331
0.7987 Intermediate Similarity NPC135538
0.7987 Intermediate Similarity NPC37144
0.7987 Intermediate Similarity NPC428
0.7987 Intermediate Similarity NPC24233
0.7987 Intermediate Similarity NPC246587
0.7987 Intermediate Similarity NPC476571
0.7987 Intermediate Similarity NPC59907
0.7987 Intermediate Similarity NPC147390
0.7977 Intermediate Similarity NPC302449
0.7976 Intermediate Similarity NPC160570
0.7975 Intermediate Similarity NPC473934
0.7965 Intermediate Similarity NPC126284
0.7964 Intermediate Similarity NPC264850
0.7964 Intermediate Similarity NPC13916
0.7953 Intermediate Similarity NPC237044
0.7952 Intermediate Similarity NPC233650
0.7952 Intermediate Similarity NPC218614
0.7935 Intermediate Similarity NPC314682
0.7919 Intermediate Similarity NPC172403
0.7914 Intermediate Similarity NPC184026
0.7914 Intermediate Similarity NPC2413
0.7914 Intermediate Similarity NPC193949
0.7914 Intermediate Similarity NPC127674
0.7914 Intermediate Similarity NPC278799
0.7914 Intermediate Similarity NPC204828
0.7914 Intermediate Similarity NPC189266
0.7914 Intermediate Similarity NPC276588
0.7914 Intermediate Similarity NPC54379
0.7914 Intermediate Similarity NPC249797
0.7914 Intermediate Similarity NPC5238
0.7914 Intermediate Similarity NPC39701
0.7914 Intermediate Similarity NPC469817
0.7914 Intermediate Similarity NPC207757
0.7914 Intermediate Similarity NPC172765
0.7914 Intermediate Similarity NPC110416
0.7914 Intermediate Similarity NPC295691
0.7907 Intermediate Similarity NPC118633
0.7907 Intermediate Similarity NPC474325
0.7907 Intermediate Similarity NPC294790
0.7907 Intermediate Similarity NPC148693
0.7904 Intermediate Similarity NPC247972
0.7904 Intermediate Similarity NPC134858
0.7904 Intermediate Similarity NPC24465
0.7901 Intermediate Similarity NPC148898
0.7895 Intermediate Similarity NPC304675
0.7885 Intermediate Similarity NPC328750
0.7885 Intermediate Similarity NPC213206
0.7885 Intermediate Similarity NPC188163
0.7885 Intermediate Similarity NPC474915
0.7882 Intermediate Similarity NPC65403
0.7874 Intermediate Similarity NPC248642
0.787 Intermediate Similarity NPC470324
0.7866 Intermediate Similarity NPC37205
0.7866 Intermediate Similarity NPC160931
0.7861 Intermediate Similarity NPC474745
0.7861 Intermediate Similarity NPC99179
0.7857 Intermediate Similarity NPC7018
0.7853 Intermediate Similarity NPC206900
0.7853 Intermediate Similarity NPC477564
0.7853 Intermediate Similarity NPC2295
0.7849 Intermediate Similarity NPC241704
0.7831 Intermediate Similarity NPC165797
0.7829 Intermediate Similarity NPC474746
0.7829 Intermediate Similarity NPC475981
0.7829 Intermediate Similarity NPC156576
0.7826 Intermediate Similarity NPC207824
0.7826 Intermediate Similarity NPC60538
0.7818 Intermediate Similarity NPC475326
0.7816 Intermediate Similarity NPC286119
0.7812 Intermediate Similarity NPC16107
0.7812 Intermediate Similarity NPC210437
0.7812 Intermediate Similarity NPC476144
0.7812 Intermediate Similarity NPC51957
0.7812 Intermediate Similarity NPC106295
0.7811 Intermediate Similarity NPC210140
0.7811 Intermediate Similarity NPC298186
0.7811 Intermediate Similarity NPC306555
0.7811 Intermediate Similarity NPC474931
0.7811 Intermediate Similarity NPC12053
0.7811 Intermediate Similarity NPC145832
0.7811 Intermediate Similarity NPC81218
0.7811 Intermediate Similarity NPC158376
0.7811 Intermediate Similarity NPC117188
0.7811 Intermediate Similarity NPC205421
0.7811 Intermediate Similarity NPC301189
0.7805 Intermediate Similarity NPC244112
0.7798 Intermediate Similarity NPC169743
0.7798 Intermediate Similarity NPC196447
0.7798 Intermediate Similarity NPC96603
0.7798 Intermediate Similarity NPC136508
0.7798 Intermediate Similarity NPC78222
0.7798 Intermediate Similarity NPC212794
0.7798 Intermediate Similarity NPC238530
0.7798 Intermediate Similarity NPC13504
0.7798 Intermediate Similarity NPC232514
0.7798 Intermediate Similarity NPC276944
0.7798 Intermediate Similarity NPC76116
0.7798 Intermediate Similarity NPC477563
0.7798 Intermediate Similarity NPC306843
0.7798 Intermediate Similarity NPC253043
0.7778 Intermediate Similarity NPC151895
0.7778 Intermediate Similarity NPC220858
0.7778 Intermediate Similarity NPC18842
0.7778 Intermediate Similarity NPC192768
0.7778 Intermediate Similarity NPC88249
0.7778 Intermediate Similarity NPC97221
0.7771 Intermediate Similarity NPC223690
0.7771 Intermediate Similarity NPC239824
0.7771 Intermediate Similarity NPC181796
0.7771 Intermediate Similarity NPC290005
0.7771 Intermediate Similarity NPC217748
0.7771 Intermediate Similarity NPC258657
0.7771 Intermediate Similarity NPC290582
0.7771 Intermediate Similarity NPC222661
0.7771 Intermediate Similarity NPC328155
0.7771 Intermediate Similarity NPC279228
0.7771 Intermediate Similarity NPC229373
0.7771 Intermediate Similarity NPC251735
0.7771 Intermediate Similarity NPC15414
0.7771 Intermediate Similarity NPC42663
0.7771 Intermediate Similarity NPC185639
0.7771 Intermediate Similarity NPC271013
0.7771 Intermediate Similarity NPC104196
0.7771 Intermediate Similarity NPC54654
0.7771 Intermediate Similarity NPC90998
0.7771 Intermediate Similarity NPC118804
0.7771 Intermediate Similarity NPC182052
0.7771 Intermediate Similarity NPC7715
0.7771 Intermediate Similarity NPC49075

  Similar Clinical/Approved Drugs

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.

●  The left chart: Distribution of similarity level between NPC78359 and all drugs/candidates.
●  The right table: Most similar clinical/approved drugs (Tc>=0.56 or Top200).

Similarity Score Similarity Level Drug ID Developmental Stage
1.0 High Similarity NPD2563 Approved
1.0 High Similarity NPD2560 Approved
0.9608 High Similarity NPD6071 Discontinued
0.858 High Similarity NPD2969 Approved
0.858 High Similarity NPD2970 Approved
0.8415 Intermediate Similarity NPD27 Approved
0.8415 Intermediate Similarity NPD2489 Approved
0.8405 Intermediate Similarity NPD3051 Approved
0.8272 Intermediate Similarity NPD7833 Phase 2
0.8272 Intermediate Similarity NPD7831 Phase 2
0.8272 Intermediate Similarity NPD7832 Clinical (unspecified phase)
0.8187 Intermediate Similarity NPD4772 Phase 2
0.8187 Intermediate Similarity NPD4773 Phase 2
0.8023 Intermediate Similarity NPD7312 Approved
0.8023 Intermediate Similarity NPD7313 Approved
0.8023 Intermediate Similarity NPD7311 Approved
0.8023 Intermediate Similarity NPD7310 Approved
0.7977 Intermediate Similarity NPD7309 Approved
0.7976 Intermediate Similarity NPD4481 Phase 3
0.7943 Intermediate Similarity NPD7906 Approved
0.7919 Intermediate Similarity NPD4578 Approved
0.7919 Intermediate Similarity NPD4577 Approved
0.7886 Intermediate Similarity NPD4663 Approved
0.7885 Intermediate Similarity NPD4664 Clinical (unspecified phase)
0.787 Intermediate Similarity NPD2898 Approved
0.7867 Intermediate Similarity NPD5752 Clinical (unspecified phase)
0.7866 Intermediate Similarity NPD6818 Clinical (unspecified phase)
0.7848 Intermediate Similarity NPD5241 Discontinued
0.7834 Intermediate Similarity NPD4237 Approved
0.7834 Intermediate Similarity NPD4236 Phase 3
0.7812 Intermediate Similarity NPD4584 Approved
0.7806 Intermediate Similarity NPD6029 Clinical (unspecified phase)
0.7806 Intermediate Similarity NPD6028 Clinical (unspecified phase)
0.7778 Intermediate Similarity NPD2238 Phase 2
0.7771 Intermediate Similarity NPD8053 Approved
0.7771 Intermediate Similarity NPD8054 Approved
0.7758 Intermediate Similarity NPD5773 Approved
0.7758 Intermediate Similarity NPD5772 Approved
0.7733 Intermediate Similarity NPD8156 Discontinued
0.7722 Intermediate Similarity NPD5177 Phase 3
0.7722 Intermediate Similarity NPD3060 Approved
0.7716 Intermediate Similarity NPD6031 Approved
0.7716 Intermediate Similarity NPD6030 Approved
0.7716 Intermediate Similarity NPD5976 Discontinued
0.7702 Intermediate Similarity NPD4123 Phase 3
0.7702 Intermediate Similarity NPD1754 Clinical (unspecified phase)
0.7674 Intermediate Similarity NPD8252 Approved
0.7674 Intermediate Similarity NPD8251 Approved
0.7674 Intermediate Similarity NPD8099 Discontinued
0.7669 Intermediate Similarity NPD3687 Approved
0.7669 Intermediate Similarity NPD3686 Approved
0.7669 Intermediate Similarity NPD4210 Discontinued
0.7643 Intermediate Similarity NPD2161 Phase 2
0.7625 Intermediate Similarity NPD5307 Clinical (unspecified phase)
0.761 Intermediate Similarity NPD4162 Approved
0.7593 Intermediate Similarity NPD1424 Approved
0.7582 Intermediate Similarity NPD2669 Clinical (unspecified phase)
0.7578 Intermediate Similarity NPD7124 Phase 2
0.7576 Intermediate Similarity NPD4678 Approved
0.7576 Intermediate Similarity NPD4675 Approved
0.756 Intermediate Similarity NPD4581 Clinical (unspecified phase)
0.7556 Intermediate Similarity NPD2488 Approved
0.7556 Intermediate Similarity NPD2490 Approved
0.7529 Intermediate Similarity NPD3365 Discontinued
0.7516 Intermediate Similarity NPD6896 Approved
0.7516 Intermediate Similarity NPD2677 Approved
0.7516 Intermediate Similarity NPD5084 Clinical (unspecified phase)
0.7516 Intermediate Similarity NPD6895 Approved
0.7515 Intermediate Similarity NPD7261 Clinical (unspecified phase)
0.7514 Intermediate Similarity NPD2971 Approved
0.7514 Intermediate Similarity NPD2968 Approved
0.7484 Intermediate Similarity NPD1375 Discontinued
0.7484 Intermediate Similarity NPD2674 Phase 3
0.7469 Intermediate Similarity NPD6666 Approved
0.7469 Intermediate Similarity NPD6667 Approved
0.7456 Intermediate Similarity NPD6788 Approved
0.7453 Intermediate Similarity NPD6331 Phase 2
0.7446 Intermediate Similarity NPD2973 Approved
0.7446 Intermediate Similarity NPD2975 Approved
0.7446 Intermediate Similarity NPD2974 Approved
0.7439 Intermediate Similarity NPD6090 Discontinued
0.7438 Intermediate Similarity NPD1372 Clinical (unspecified phase)
0.7438 Intermediate Similarity NPD7153 Discontinued
0.7425 Intermediate Similarity NPD6072 Discontinued
0.7412 Intermediate Similarity NPD4055 Discovery
0.741 Intermediate Similarity NPD4017 Approved
0.7407 Intermediate Similarity NPD3692 Discontinued
0.7405 Intermediate Similarity NPD6111 Discontinued
0.7394 Intermediate Similarity NPD3641 Approved
0.7394 Intermediate Similarity NPD3640 Phase 3
0.7394 Intermediate Similarity NPD3639 Approved
0.7381 Intermediate Similarity NPD5720 Discontinued
0.738 Intermediate Similarity NPD3450 Approved
0.738 Intermediate Similarity NPD3452 Approved
0.738 Intermediate Similarity NPD2493 Approved
0.738 Intermediate Similarity NPD2494 Approved
0.7378 Intermediate Similarity NPD7019 Approved
0.7378 Intermediate Similarity NPD7020 Approved
0.7372 Intermediate Similarity NPD4475 Approved
0.7372 Intermediate Similarity NPD4474 Approved
0.7362 Intermediate Similarity NPD6783 Clinical (unspecified phase)
0.734 Intermediate Similarity NPD3057 Approved
0.7337 Intermediate Similarity NPD2978 Approved
0.7337 Intermediate Similarity NPD2977 Approved
0.7333 Intermediate Similarity NPD5261 Clinical (unspecified phase)
0.7326 Intermediate Similarity NPD4580 Approved
0.7326 Intermediate Similarity NPD7201 Clinical (unspecified phase)
0.7315 Intermediate Similarity NPD3445 Approved
0.7315 Intermediate Similarity NPD3444 Approved
0.7315 Intermediate Similarity NPD3443 Approved
0.7308 Intermediate Similarity NPD5718 Phase 2
0.7308 Intermediate Similarity NPD3144 Approved
0.7308 Intermediate Similarity NPD3145 Approved
0.7297 Intermediate Similarity NPD7667 Clinical (unspecified phase)
0.7267 Intermediate Similarity NPD5709 Phase 3
0.7267 Intermediate Similarity NPD2029 Clinical (unspecified phase)
0.7263 Intermediate Similarity NPD4583 Approved
0.7263 Intermediate Similarity NPD4582 Approved
0.7249 Intermediate Similarity NPD2972 Approved
0.7249 Intermediate Similarity NPD3533 Approved
0.7241 Intermediate Similarity NPD4010 Discontinued
0.7239 Intermediate Similarity NPD6658 Clinical (unspecified phase)
0.7237 Intermediate Similarity NPD2233 Approved
0.7237 Intermediate Similarity NPD2230 Approved
0.7237 Intermediate Similarity NPD2232 Approved
0.7233 Intermediate Similarity NPD2157 Approved
0.7229 Intermediate Similarity NPD7526 Approved
0.7229 Intermediate Similarity NPD52 Approved
0.7229 Intermediate Similarity NPD7527 Clinical (unspecified phase)
0.7228 Intermediate Similarity NPD7296 Approved
0.7226 Intermediate Similarity NPD1712 Approved
0.7225 Intermediate Similarity NPD4666 Phase 3
0.7222 Intermediate Similarity NPD7037 Approved
0.7222 Intermediate Similarity NPD2170 Clinical (unspecified phase)
0.7211 Intermediate Similarity NPD4002 Approved
0.7211 Intermediate Similarity NPD4004 Approved
0.7202 Intermediate Similarity NPD6523 Clinical (unspecified phase)
0.7202 Intermediate Similarity NPD4005 Discontinued
0.7195 Intermediate Similarity NPD5160 Discontinued
0.7186 Intermediate Similarity NPD2122 Discontinued
0.7186 Intermediate Similarity NPD6662 Clinical (unspecified phase)
0.7184 Intermediate Similarity NPD6107 Approved
0.7176 Intermediate Similarity NPD7298 Approved
0.7174 Intermediate Similarity NPD5525 Clinical (unspecified phase)
0.7169 Intermediate Similarity NPD4160 Clinical (unspecified phase)
0.7158 Intermediate Similarity NPD3398 Discontinued
0.7158 Intermediate Similarity NPD3448 Approved
0.7158 Intermediate Similarity NPD2491 Approved
0.7152 Intermediate Similarity NPD2667 Approved
0.7152 Intermediate Similarity NPD2668 Approved
0.7143 Intermediate Similarity NPD2156 Approved
0.7143 Intermediate Similarity NPD2155 Approved
0.7143 Intermediate Similarity NPD2154 Approved
0.7135 Intermediate Similarity NPD4873 Discontinued
0.7134 Intermediate Similarity NPD6748 Discontinued
0.7128 Intermediate Similarity NPD4420 Approved
0.7126 Intermediate Similarity NPD3647 Clinical (unspecified phase)
0.7126 Intermediate Similarity NPD2041 Clinical (unspecified phase)
0.7126 Intermediate Similarity NPD5677 Discontinued
0.7126 Intermediate Similarity NPD2042 Clinical (unspecified phase)
0.7125 Intermediate Similarity NPD3054 Approved
0.7125 Intermediate Similarity NPD3052 Approved
0.711 Intermediate Similarity NPD5604 Discontinued
0.7108 Intermediate Similarity NPD7213 Phase 3
0.7108 Intermediate Similarity NPD7212 Phase 2
0.7108 Intermediate Similarity NPD1774 Approved
0.7102 Intermediate Similarity NPD6688 Approved
0.7102 Intermediate Similarity NPD6687 Approved
0.7099 Intermediate Similarity NPD4477 Approved
0.7099 Intermediate Similarity NPD4476 Approved
0.7095 Intermediate Similarity NPD1791 Approved
0.7095 Intermediate Similarity NPD1793 Approved
0.7089 Intermediate Similarity NPD2028 Clinical (unspecified phase)
0.7081 Intermediate Similarity NPD2200 Suspended
0.7081 Intermediate Similarity NPD3808 Clinical (unspecified phase)
0.7072 Intermediate Similarity NPD7549 Discontinued
0.7066 Intermediate Similarity NPD7447 Phase 1
0.7059 Intermediate Similarity NPD6876 Approved
0.7059 Intermediate Similarity NPD6875 Approved
0.7055 Intermediate Similarity NPD3656 Approved
0.7051 Intermediate Similarity NPD6584 Phase 3
0.7051 Intermediate Similarity NPD7905 Discontinued
0.7045 Intermediate Similarity NPD4166 Phase 2
0.7039 Intermediate Similarity NPD6042 Phase 2
0.7039 Intermediate Similarity NPD1751 Approved
0.7039 Intermediate Similarity NPD42 Phase 2
0.7037 Intermediate Similarity NPD1753 Discontinued
0.7035 Intermediate Similarity NPD4585 Approved
0.703 Intermediate Similarity NPD7466 Approved
0.7025 Intermediate Similarity NPD3027 Phase 3
0.7019 Intermediate Similarity NPD2653 Approved
0.7018 Intermediate Similarity NPD7110 Phase 1
0.7018 Intermediate Similarity NPD7109 Clinical (unspecified phase)
0.7018 Intermediate Similarity NPD5089 Approved
0.7018 Intermediate Similarity NPD5090 Approved
0.7017 Intermediate Similarity NPD3303 Discontinued
0.7011 Intermediate Similarity NPD7975 Clinical (unspecified phase)
0.7006 Intermediate Similarity NPD2421 Approved
0.7006 Intermediate Similarity NPD2420 Approved
0.7006 Intermediate Similarity NPD6087 Phase 1

Structure

External Identifiers

PubChem CID   9651
ChEMBL   CHEMBL659
ZINC  

Physicochemical Properties

Molecular Weight:  287.15
ALogP:  -0.5627
MLogP:  2.89
XLogP:  1.062
# Rotatable Bonds:  4
Polar Surface Area:  41.93
# H-Bond Aceptor:  2
# H-Bond Donor:  1
# Rings:  4
# Heavy Atoms:  21

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General Info & Identifiers & Properties  
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Source Organisms  
Biological Activities  
Similar NPs/Drugs