Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO22273 | Angelica pubescens | Species | Apiaceae | Eukaryota |
PMID[21627108] |
|||
NPO19017 | Prangos pabularia | Species | Apiaceae | Eukaryota | TCMID* | |||
NPO12850 | Leiothrix flavescens | Species | Eriocaulaceae | Eukaryota | UNPD* | |||
NPO2715 | Murraya paniculata | Species | Rutaceae | Eukaryota | TCM_Taiwan* | |||
NPO6200 | Clausena sp. | Species | Rutaceae | Eukaryota | TCMID* | |||
NPO8119 | Ambrosia polystachya | Species | Asteraceae | Eukaryota | UNPD* | |||
NPO15544 | Cnidium monnieri | Species | Apiaceae | Eukaryota | TCMID* | |||
NPO18214 | Spilanthes ocymifolia | Species | Asteraceae | Eukaryota | UNPD* | |||
NPO22273 | Angelica pubescens | Species | Apiaceae | Eukaryota | TCMID* | |||
NPO15022 | Baccharis flabellata | Species | Asteraceae | Eukaryota | UNPD* | |||
NPO18007.1 | Agrimonia pilosa var. japonica | Varieties | Rosaceae | Eukaryota | TCMID* | |||
NPO1117 | Hypholoma capnoides | Species | Strophariaceae | Eukaryota | UNPD* | |||
NPO6190 | Angelica archangelica | Species | Apiaceae | Eukaryota | TCMID* | |||
NPO13583 | Daphne cannabina | Species | Thymelaeaceae | Eukaryota | UNPD* | |||
NPO2392 | Hansenia weberbaueriana | Species | Apiaceae | Eukaryota | TCMID* | |||
NPO662 | Angelica officinalis | Species | Apiaceae | Eukaryota | UNPD* | |||
NPO11844 | Siphula applanata | Species | Icmadophilaceae | Eukaryota | UNPD* | |||
NPO29109 | Clausena anisata | Species | Rutaceae | Eukaryota | TCMID* | |||
NPO22063 | Solanum lycocarpum | Species | Solanaceae | Eukaryota | UNPD* | |||
NPO2715 | Murraya paniculata | Species | Rutaceae | Eukaryota | HerDing* | |||
NPO2715 | Murraya paniculata | Species | Rutaceae | Eukaryota | TCMID* | |||
NPO13159 | Sauropus quadrangularis | Species | Phyllanthaceae | Eukaryota | UNPD* | |||
NPO29109 | Clausena anisata | Species | Rutaceae | Eukaryota | TCM_Taiwan* | |||
NPO6125 | Peucedanum ostruthium | Species | Apiaceae | Eukaryota | TCMID* | |||
NPO9366 | Rosa transmorrisonensis | Species | Rosaceae | Eukaryota | UNPD* | |||
NPO29109 | Clausena anisata | Species | Rutaceae | Eukaryota | HerDing* | |||
NPO25178 | Radix heraclei maximi | Species | Lymnaeidae | Eukaryota | TCMID* | |||
NPO18674 | Juglans regia | Species | Juglandaceae | Eukaryota | UNPD* | |||
NPO30526 | Notopterygium incisum | NA | NA | NA | HerDing* | |||
NPO17866 | Peucedanum rubricaule | Species | Apiaceae | Eukaryota | TCMID* | |||
NPO19219 | Inga paterno | Species | Fabaceae | Eukaryota | UNPD* | |||
NPO31235 | Citrus sp | Species | Rutaceae | Eukaryota | HerDing* | |||
NPO6125 | Peucedanum ostruthium | Species | Apiaceae | Eukaryota | UNPD* | |||
NPO18926 | Tephrosia lupinifolia | Species | Geometridae | Eukaryota | UNPD* | |||
NPO31335 | Clausena sp | Species | Rutaceae | Eukaryota | HerDing* | |||
NPO5820 | Phegopteris subaurita | Species | Thelypteridaceae | Eukaryota | UNPD* | |||
NPO11708 | Cyathus helenae | Species | Nidulariaceae | Eukaryota | UNPD* | |||
NPO6125 | Peucedanum ostruthium | Species | Apiaceae | Eukaryota | TCM_Taiwan* | |||
NPO19012 | Gasteria bicolor | Species | Asphodelaceae | Eukaryota | UNPD* | |||
NPO15484 | Adlumia fungosa | Species | Papaveraceae | Eukaryota | UNPD* | |||
NPO6125 | Peucedanum ostruthium | Species | Apiaceae | Eukaryota | HerDing* | |||
NPO18316 | Vernonia echitifolia | Species | Asteraceae | Eukaryota | UNPD* | |||
NPO24758 | Angelica dahurica | Species | Apiaceae | Eukaryota | TCMSP* | |||
NPO6125 | Peucedanum ostruthium | Species | Apiaceae | Eukaryota | Rhizomes |
PMID[21627108] |
||
NPO20244 | Melicope semecarpifolia | Species | Rutaceae | Eukaryota |
PMID[11575945] |
|||
NPO29603 | Saussureae involucratae herba | NA | NA | NA | TCMSP* | |||
NPO6125 | Peucedanum ostruthium | Species | Apiaceae | Eukaryota | Root |
PMID[21627108] |
||
NPO16087 | Atractylodes lancea | Species | Asteraceae | Eukaryota |
PMID[9544564] |
|||
NPO29700 | Peucedani radix | NA | NA | NA | TCMSP* | |||
NPO6190 | Angelica archangelica | Species | Apiaceae | Eukaryota | TCM_Taiwan* | |||
NPO15544 | Cnidium monnieri | Species | Apiaceae | Eukaryota |
PMID[21625478] |
|||
NPO13736 | Cnidii fructus | NA | NA | NA | TCMSP* | |||
NPO6190 | Angelica archangelica | Species | Apiaceae | Eukaryota | HerDing* | |||
NPO33003 | murraya alata | Species | Rutaceae | Eukaryota | Leaves |
PMID[25621853] |
||
NPO13103 | Radix angelicae biseratae | Species | Lymnaeidae | Eukaryota | TCMSP* | |||
NPO24758 | Angelica dahurica | Species | Apiaceae | Eukaryota | TM-MC* | |||
NPO33671 | Selinum monniere | Species | Apiaceae | Eukaryota |
PMID[3069958] |
|||
NPO11762 | Agrimonia eupatoria | Species | Rosaceae | Eukaryota | TCMSP* | |||
NPO22273 | Angelica pubescens | Species | Apiaceae | Eukaryota | TM-MC* | |||
NPO13639 | Smilax macrophylla | Species | Staphylinidae | Eukaryota | UNPD* | |||
NPO5603 | Eupatorium fortunei turcz | Species | Asteraceae | Eukaryota | TCMSP* | |||
NPO3127 | Aralia continentalis | Species | Araliaceae | Eukaryota | TM-MC* | |||
NPO10004 | Callitropsis nootkatensis | Species | Cupressaceae | Eukaryota | UNPD* | |||
NPO15544 | Cnidium monnieri | Species | Apiaceae | Eukaryota | HerDing* | |||
NPO7317 | Citrus aurantium | Species | Rutaceae | Eukaryota | TM-MC* | |||
NPO2629 | Cystoseira caespitosa | Species | Sargassaceae | Eukaryota | UNPD* | |||
NPO17866 | Peucedanum rubricaule | Species | Apiaceae | Eukaryota | TCM_Taiwan* | |||
NPO27288 | Citrus maxima | Species | Rutaceae | Eukaryota | TM-MC* | |||
NPO13877 | Wedelia forsteriana | Species | Asteraceae | Eukaryota | UNPD* | |||
NPO17866 | Peucedanum rubricaule | Species | Apiaceae | Eukaryota | HerDing* | |||
NPO15730 | Citrus medica | Species | Rutaceae | Eukaryota | TM-MC* | |||
NPO11147 | Spongia hispida | Species | Spongiidae | Eukaryota | UNPD* | |||
NPO18007 | Agrimonia pilosa | Species | Rosaceae | Eukaryota | TCM_Taiwan* | |||
NPO16308 | Citrus wilsonii | Species | Rutaceae | Eukaryota | TM-MC* | |||
NPO14231 | Senecio barba-johannis | Species | Asteraceae | Eukaryota | UNPD* | |||
NPO18007.1 | Agrimonia pilosa var. japonica | Varieties | Rosaceae | Eukaryota | HerDing* | |||
NPO900 | Cnidium monieri | Species | Apiaceae | Eukaryota | TM-MC* | |||
NPO16778 | Leptospermum liversidgei | Species | Myrtaceae | Eukaryota | UNPD* | |||
NPO19017 | Prangos pabularia | Species | Apiaceae | Eukaryota | TCM_Taiwan* | |||
NPO15544 | Cnidium monnieri | Species | Apiaceae | Eukaryota | TM-MC* | |||
NPO19744 | Arnica foliosa | Species | Asteraceae | Eukaryota | UNPD* | |||
NPO19017 | Prangos pabularia | Species | Apiaceae | Eukaryota | HerDing* | |||
NPO23548 | Leonurus japonicus | Species | Lamiaceae | Eukaryota | TM-MC* | |||
NPO24248.1 | Lactarius deliciosus var. deterrimus | Varieties | Russulaceae | Eukaryota | UNPD* | |||
NPO22273 | Angelica pubescens | Species | Apiaceae | Eukaryota | TCM_Taiwan* | |||
NPO12662 | Torilis japonica | Species | Apiaceae | Eukaryota | TM-MC* | |||
NPO18895 | Eucalyptus exserta | Species | Myrtaceae | Eukaryota | UNPD* | |||
NPO22273 | Angelica pubescens | Species | Apiaceae | Eukaryota | HerDing* | |||
NPO1141 | Citrus sp. | Species | Rutaceae | Eukaryota | TCMID* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT3171 | Cell Line | V79 | Cricetulus griseus | IC50 | = | 57000 | nM | 10.1016/0960-894X(96)00315-0 |
NPT91 | Cell Line | KB | Homo sapiens | IC50 | = | 12 | ug/ml | 10.1016/0960-894X(96)00315-0 |
NPT168 | Cell Line | P388 | Mus musculus | IC50 | = | 3.1 | ug/ml | 10.1016/0960-894X(96)00315-0 |
NPT4114 | Cell Line | MM46 | Mus musculus | IC50 | = | 8.6 | ug/ml | 10.1016/0960-894X(96)00315-0 |
NPT1224 | Individual Protein | Glyceraldehyde-3-phosphate dehydrogenase liver | Homo sapiens | IC50 | = | 208929.61 | nM | 15081008 |
NPT566 | Organism | Salmonella typhimurium | Salmonella enterica subsp. enterica serovar Typhimurium | Inhibition | = | 68 | % | 3069958 |
NPT566 | Organism | Salmonella typhimurium | Salmonella enterica subsp. enterica serovar Typhimurium | Inhibition | = | 0 | % | 3069958 |
NPT566 | Organism | Salmonella typhimurium | Salmonella enterica subsp. enterica serovar Typhimurium | Inhibition | = | 74 | % | 3069958 |
NPT566 | Organism | Salmonella typhimurium | Salmonella enterica subsp. enterica serovar Typhimurium | Inhibition | = | 56 | % | 3069958 |
NPT566 | Organism | Salmonella typhimurium | Salmonella enterica subsp. enterica serovar Typhimurium | Inhibition | = | 51 | % | 3069958 |
NPT566 | Organism | Salmonella typhimurium | Salmonella enterica subsp. enterica serovar Typhimurium | Inhibition | = | 54 | % | 3069958 |
NPT566 | Organism | Salmonella typhimurium | Salmonella enterica subsp. enterica serovar Typhimurium | Inhibition | = | 49 | % | 3069958 |
NPT566 | Organism | Salmonella typhimurium | Salmonella enterica subsp. enterica serovar Typhimurium | Inhibition | = | 13 | % | 3069958 |
NPT566 | Organism | Salmonella typhimurium | Salmonella enterica subsp. enterica serovar Typhimurium | Inhibition | = | 80 | % | 3069958 |
NPT566 | Organism | Salmonella typhimurium | Salmonella enterica subsp. enterica serovar Typhimurium | Inhibition | = | 55 | % | 3069958 |
NPT566 | Organism | Salmonella typhimurium | Salmonella enterica subsp. enterica serovar Typhimurium | Inhibition | = | 29 | % | 3069958 |
NPT2 | Others | Unspecified | Inhibition | = | 86.6 | % | 11575945 | |
NPT2 | Others | Unspecified | Inhibition | = | 0 | % | 11575945 | |
NPT2 | Others | Unspecified | Inhibition | = | 7.4 | % | 11575945 | |
NPT2 | Others | Unspecified | Inhibition | = | 52.6 | % | 11575945 | |
NPT2 | Others | Unspecified | Inhibition | = | 7 | % | 11575945 | |
NPT2 | Others | Unspecified | Inhibition | = | 88.6 | % | 11575945 | |
NPT2 | Others | Unspecified | Inhibition | = | 84.5 | % | 11575945 | |
NPT2 | Others | Unspecified | Inhibition | = | 88.1 | % | 11575945 | |
NPT2 | Others | Unspecified | Inhibition | = | 90 | % | 11575945 | |
NPT570 | Individual Protein | Arachidonate 5-lipoxygenase | Homo sapiens | IC50 | = | 36200 | nM | 9544564 |
NPT30 | Individual Protein | Cyclooxygenase-1 | Homo sapiens | IC50 | > | 200000 | nM | 9544564 |
NPT2 | Others | Unspecified | Activity | = | 16.8 | ug/ml | 20104880 | |
NPT2 | Others | Unspecified | Activity | = | 187.3 | ug/ml | 20104880 | |
NPT2 | Others | Unspecified | Activity | = | 80.5 | ug/ml | 20346658 | |
NPT2 | Others | Unspecified | Activity | = | 12.4 | ug/ml | 20346658 | |
NPT4115 | Individual Protein | Exportin-1 | Homo sapiens | IC50 | = | 1600 | nM | 20493693 |
NPT83 | Cell Line | MCF7 | Homo sapiens | IC50 | = | 25800 | nM | 21051232 |
NPT82 | Cell Line | MDA-MB-231 | Homo sapiens | IC50 | = | 30200 | nM | 21051232 |
NPT94 | Individual Protein | Aldehyde dehydrogenase 1A1 | Homo sapiens | Potency | = | 44668.4 | nM | PubChem BioAssay data set |
NPT94 | Individual Protein | Aldehyde dehydrogenase 1A1 | Homo sapiens | Potency | = | 28183.8 | nM | PubChem BioAssay data set |
NPT442 | Individual Protein | Ferritin light chain | Equus caballus | Potency | = | 44668.4 | nM | PubChem BioAssay data set |
NPT109 | Individual Protein | Cytochrome P450 3A4 | Homo sapiens | Potency | = | 15848.9 | nM | PubChem BioAssay data set |
NPT61 | Individual Protein | Beta-glucocerebrosidase | Homo sapiens | Potency | 15848.9 | nM | PubChem BioAssay data set | |
NPT61 | Individual Protein | Beta-glucocerebrosidase | Homo sapiens | Potency | 28183.8 | nM | PubChem BioAssay data set | |
NPT2 | Others | Unspecified | Potency | 23109.3 | nM | PubChem BioAssay data set | ||
NPT2657 | Cell Line | A10 | Rattus norvegicus | IC50 | = | 13600 | nM | 21627108 |
NPT135 | Individual Protein | Chromobox protein homolog 1 | Homo sapiens | Potency | 63095.7 | nM | PubChem BioAssay data set | |
NPT444 | Individual Protein | Ubiquitin carboxyl-terminal hydrolase 1 | Homo sapiens | Potency | 56234.1 | nM | PubChem BioAssay data set | |
NPT740 | Individual Protein | Beta-secretase 1 | Homo sapiens | IC50 | > | 500000 | nM | 22222157 |
NPT740 | Individual Protein | Beta-secretase 1 | Homo sapiens | Inhibition | = | 39.4 | % | 22222157 |
NPT10 | Individual Protein | Geminin | Homo sapiens | Potency | 29092.9 | nM | PubChem BioAssay data set | |
NPT101 | Individual Protein | Glucagon-like peptide 1 receptor | Homo sapiens | Potency | 1778.3 | nM | PubChem BioAssay data set | |
NPT66 | Individual Protein | Acetylcholinesterase | Electrophorus electricus | Inhibition | = | 3.31 | % | 23062825 |
NPT67 | Individual Protein | Cholinesterase | Equus caballus | Inhibition | = | -0.19 | % | 23062825 |
NPT88 | Organism | Mycobacterium tuberculosis | Mycobacterium tuberculosis | MIC | = | 32 | ug/ml | 23369537 |
NPT73 | Individual Protein | Solute carrier organic anion transporter family member 1B1 | Homo sapiens | Inhibition | = | 227.14 | % | 23571415 |
NPT72 | Individual Protein | Solute carrier organic anion transporter family member 1B3 | Homo sapiens | Inhibition | = | 121.31 | % | 23571415 |
NPT2 | Others | Unspecified | Potency | 472.8 | nM | PubChem BioAssay data set | ||
NPT161 | Individual Protein | Rap guanine nucleotide exchange factor 4 | Homo sapiens | Potency | 50118.7 | nM | PubChem BioAssay data set | |
NPT2 | Others | Unspecified | Potency | 18821.2 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 118.8 | nM | PubChem BioAssay data set | ||
NPT407 | Cell Line | COLO 205 | Homo sapiens | IC50 | > | 60000 | nM | 25062005 |
NPT2 | Others | Unspecified | IC50 | = | 30200 | nM | 25062005 | |
NPT396 | Cell Line | T47D | Homo sapiens | IC50 | = | 42400 | nM | 25062005 |
NPT2 | Others | Unspecified | IC50 | = | 30900 | nM | 25062005 | |
NPT81 | Cell Line | A549 | Homo sapiens | IC50 | = | 46200 | nM | 25062005 |
NPT2 | Others | Unspecified | IC50 | = | 24800 | nM | 25062005 | |
NPT1718 | Cell Line | A431 | Homo sapiens | IC50 | = | 23200 | nM | 25062005 |
NPT65 | Cell Line | HepG2 | Homo sapiens | IC50 | = | 161400 | nM | 25461322 |
NPT113 | Cell Line | RAW264.7 | Mus musculus | IC50 | = | 12400 | nM | 25621853 |
NPT109 | Individual Protein | Cytochrome P450 3A4 | Homo sapiens | Inhibition | = | 27.3 | % | 10.1039/C4MD00196F |
NPT110 | Individual Protein | Cytochrome P450 2D6 | Homo sapiens | Inhibition | = | 60.5 | % | 10.1039/C4MD00196F |
NPT212 | Individual Protein | Cytochrome P450 2C9 | Homo sapiens | Inhibition | = | 39.8 | % | 10.1039/C4MD00196F |
NPT213 | Individual Protein | Cytochrome P450 2C19 | Homo sapiens | Inhibition | = | 56.5 | % | 10.1039/C4MD00196F |
NPT2794 | Individual Protein | Quinolone resistance protein norA | Staphylococcus aureus | MIC | = | 2 | ug/ml | 10.1039/C4MD00196F |
NPT2794 | Individual Protein | Quinolone resistance protein norA | Staphylococcus aureus | FC | = | 4 | 10.1039/C4MD00196F | |
NPT2 | Others | Unspecified | MIC | = | 16 | ug/ml | 10.1039/C4MD00196F | |
NPT2 | Others | Unspecified | FC | = | 2 | 10.1039/C4MD00196F | ||
NPT2 | Others | Unspecified | MIC | = | 64 | ug/ml | 10.1039/C4MD00196F | |
NPT2 | Others | Unspecified | FC | = | 0 | 10.1039/C4MD00196F | ||
NPT2795 | Individual Protein | Fluoroquinolone resistance protein | Staphylococcus aureus | MIC | = | 256 | ug/ml | 10.1039/C4MD00196F |
NPT2795 | Individual Protein | Fluoroquinolone resistance protein | Staphylococcus aureus | FC | = | 0 | 10.1039/C4MD00196F | |
NPT668 | Individual Protein | P-glycoprotein 1 | Homo sapiens | IC50 | = | 34000 | nM | 10.1039/C4MD00196F |
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 NPC96286 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 | NPC248429 |
0.9914 | High Similarity | NPC472518 |
0.9829 | High Similarity | NPC201667 |
0.9829 | High Similarity | NPC73413 |
0.9744 | High Similarity | NPC273772 |
0.9744 | High Similarity | NPC109675 |
0.9661 | High Similarity | NPC27671 |
0.958 | High Similarity | NPC471828 |
0.958 | High Similarity | NPC471827 |
0.9573 | High Similarity | NPC144418 |
0.9565 | High Similarity | NPC96705 |
0.9565 | High Similarity | NPC265547 |
0.9504 | High Similarity | NPC185066 |
0.9504 | High Similarity | NPC472519 |
0.95 | High Similarity | NPC471826 |
0.95 | High Similarity | NPC234109 |
0.95 | High Similarity | NPC188327 |
0.9496 | High Similarity | NPC111347 |
0.9496 | High Similarity | NPC291899 |
0.9492 | High Similarity | NPC257188 |
0.9492 | High Similarity | NPC13007 |
0.9487 | High Similarity | NPC163200 |
0.9487 | High Similarity | NPC180006 |
0.9487 | High Similarity | NPC235190 |
0.9483 | High Similarity | NPC281356 |
0.9483 | High Similarity | NPC298796 |
0.9426 | High Similarity | NPC168710 |
0.9421 | High Similarity | NPC243688 |
0.9417 | High Similarity | NPC93219 |
0.9417 | High Similarity | NPC244495 |
0.9412 | High Similarity | NPC173350 |
0.9412 | High Similarity | NPC154176 |
0.9412 | High Similarity | NPC290605 |
0.9397 | High Similarity | NPC152306 |
0.9391 | High Similarity | NPC128633 |
0.935 | High Similarity | NPC80170 |
0.9344 | High Similarity | NPC199204 |
0.925 | High Similarity | NPC50720 |
0.925 | High Similarity | NPC315807 |
0.92 | High Similarity | NPC14248 |
0.9187 | High Similarity | NPC157212 |
0.9167 | High Similarity | NPC150214 |
0.9127 | High Similarity | NPC207002 |
0.9127 | High Similarity | NPC222036 |
0.9127 | High Similarity | NPC133956 |
0.9127 | High Similarity | NPC296624 |
0.9127 | High Similarity | NPC318400 |
0.9127 | High Similarity | NPC55147 |
0.9127 | High Similarity | NPC471910 |
0.9127 | High Similarity | NPC7526 |
0.9127 | High Similarity | NPC167111 |
0.9127 | High Similarity | NPC31849 |
0.9083 | High Similarity | NPC52247 |
0.9055 | High Similarity | NPC267412 |
0.9055 | High Similarity | NPC127888 |
0.9055 | High Similarity | NPC84894 |
0.9055 | High Similarity | NPC287182 |
0.9055 | High Similarity | NPC166672 |
0.9055 | High Similarity | NPC195343 |
0.9055 | High Similarity | NPC198381 |
0.9055 | High Similarity | NPC326600 |
0.9055 | High Similarity | NPC50896 |
0.9055 | High Similarity | NPC62366 |
0.9055 | High Similarity | NPC164269 |
0.9055 | High Similarity | NPC307412 |
0.9055 | High Similarity | NPC204353 |
0.9055 | High Similarity | NPC55149 |
0.9055 | High Similarity | NPC18804 |
0.9055 | High Similarity | NPC74655 |
0.9055 | High Similarity | NPC100986 |
0.9055 | High Similarity | NPC47163 |
0.9055 | High Similarity | NPC260265 |
0.9055 | High Similarity | NPC319859 |
0.9048 | High Similarity | NPC19157 |
0.9048 | High Similarity | NPC175159 |
0.9048 | High Similarity | NPC194277 |
0.904 | High Similarity | NPC32463 |
0.8984 | High Similarity | NPC471625 |
0.8984 | High Similarity | NPC472424 |
0.8984 | High Similarity | NPC86892 |
0.8984 | High Similarity | NPC281241 |
0.8984 | High Similarity | NPC471909 |
0.8984 | High Similarity | NPC469675 |
0.8976 | High Similarity | NPC163557 |
0.8976 | High Similarity | NPC54503 |
0.8976 | High Similarity | NPC472524 |
0.8968 | High Similarity | NPC472517 |
0.8952 | High Similarity | NPC121740 |
0.8952 | High Similarity | NPC289316 |
0.8952 | High Similarity | NPC258567 |
0.8952 | High Similarity | NPC224774 |
0.8943 | High Similarity | NPC202594 |
0.8943 | High Similarity | NPC232692 |
0.8934 | High Similarity | NPC143725 |
0.8926 | High Similarity | NPC187868 |
0.8917 | High Similarity | NPC247553 |
0.8915 | High Similarity | NPC283019 |
0.8915 | High Similarity | NPC55615 |
0.8915 | High Similarity | NPC177281 |
0.8915 | High Similarity | NPC26954 |
0.8915 | High Similarity | NPC38099 |
0.8915 | High Similarity | NPC283331 |
0.8915 | High Similarity | NPC149320 |
0.8915 | High Similarity | NPC476455 |
0.8915 | High Similarity | NPC160727 |
0.8915 | High Similarity | NPC128529 |
0.8915 | High Similarity | NPC471630 |
0.8906 | High Similarity | NPC180716 |
0.8906 | High Similarity | NPC253574 |
0.8906 | High Similarity | NPC213173 |
0.8906 | High Similarity | NPC98179 |
0.8906 | High Similarity | NPC224475 |
0.8898 | High Similarity | NPC469956 |
0.8889 | High Similarity | NPC113098 |
0.888 | High Similarity | NPC60704 |
0.888 | High Similarity | NPC293642 |
0.888 | High Similarity | NPC469453 |
0.888 | High Similarity | NPC139595 |
0.8871 | High Similarity | NPC163248 |
0.8871 | High Similarity | NPC101894 |
0.8846 | High Similarity | NPC153818 |
0.8846 | High Similarity | NPC232246 |
0.8846 | High Similarity | NPC155963 |
0.8843 | High Similarity | NPC319378 |
0.8843 | High Similarity | NPC302107 |
0.8837 | High Similarity | NPC472525 |
0.8837 | High Similarity | NPC33986 |
0.8837 | High Similarity | NPC229128 |
0.8837 | High Similarity | NPC61499 |
0.8828 | High Similarity | NPC469955 |
0.8828 | High Similarity | NPC469952 |
0.8819 | High Similarity | NPC267336 |
0.8819 | High Similarity | NPC272650 |
0.8819 | High Similarity | NPC29734 |
0.879 | High Similarity | NPC168259 |
0.8779 | High Similarity | NPC253616 |
0.8779 | High Similarity | NPC270256 |
0.8779 | High Similarity | NPC211110 |
0.8779 | High Similarity | NPC151946 |
0.8779 | High Similarity | NPC279573 |
0.8769 | High Similarity | NPC188380 |
0.8769 | High Similarity | NPC224543 |
0.8769 | High Similarity | NPC78746 |
0.876 | High Similarity | NPC131950 |
0.875 | High Similarity | NPC123954 |
0.874 | High Similarity | NPC19242 |
0.8712 | High Similarity | NPC312881 |
0.8712 | High Similarity | NPC36414 |
0.8707 | High Similarity | NPC473809 |
0.8707 | High Similarity | NPC106141 |
0.8702 | High Similarity | NPC294456 |
0.8702 | High Similarity | NPC212124 |
0.8702 | High Similarity | NPC281014 |
0.8702 | High Similarity | NPC225106 |
0.8702 | High Similarity | NPC306365 |
0.8702 | High Similarity | NPC14697 |
0.8702 | High Similarity | NPC268081 |
0.8702 | High Similarity | NPC184861 |
0.8702 | High Similarity | NPC472516 |
0.8682 | High Similarity | NPC469449 |
0.8682 | High Similarity | NPC472522 |
0.8682 | High Similarity | NPC2363 |
0.8667 | High Similarity | NPC183154 |
0.8667 | High Similarity | NPC263754 |
0.8661 | High Similarity | NPC474289 |
0.8647 | High Similarity | NPC310370 |
0.8647 | High Similarity | NPC287286 |
0.8647 | High Similarity | NPC195357 |
0.8647 | High Similarity | NPC152771 |
0.8647 | High Similarity | NPC183642 |
0.8647 | High Similarity | NPC472523 |
0.8636 | High Similarity | NPC307883 |
0.8626 | High Similarity | NPC167517 |
0.8626 | High Similarity | NPC104796 |
0.8621 | High Similarity | NPC149545 |
0.8605 | High Similarity | NPC137669 |
0.8594 | High Similarity | NPC244799 |
0.8594 | High Similarity | NPC240722 |
0.8571 | High Similarity | NPC71903 |
0.8561 | High Similarity | NPC471069 |
0.8561 | High Similarity | NPC131198 |
0.8561 | High Similarity | NPC471068 |
0.8559 | High Similarity | NPC199462 |
0.8538 | High Similarity | NPC229646 |
0.8538 | High Similarity | NPC205797 |
0.8538 | High Similarity | NPC291551 |
0.8538 | High Similarity | NPC241165 |
0.8538 | High Similarity | NPC233018 |
0.8538 | High Similarity | NPC241341 |
0.8538 | High Similarity | NPC141822 |
0.8538 | High Similarity | NPC36437 |
0.8538 | High Similarity | NPC1220 |
0.8538 | High Similarity | NPC142563 |
0.8527 | High Similarity | NPC66430 |
0.8527 | High Similarity | NPC37009 |
0.8519 | High Similarity | NPC183646 |
0.8519 | High Similarity | NPC119640 |
0.8519 | High Similarity | NPC229916 |
0.8516 | High Similarity | NPC123127 |
0.8516 | High Similarity | NPC27239 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC96286 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 |
---|---|---|---|
0.9083 | High Similarity | NPD422 | Phase 1 |
0.8583 | High Similarity | NPD1008 | Clinical (unspecified phase) |
0.8538 | High Similarity | NPD5124 | Phase 1 |
0.8538 | High Similarity | NPD5123 | Clinical (unspecified phase) |
0.845 | Intermediate Similarity | NPD1296 | Phase 2 |
0.8435 | Intermediate Similarity | NPD9697 | Approved |
0.8235 | Intermediate Similarity | NPD1243 | Approved |
0.8168 | Intermediate Similarity | NPD6859 | Clinical (unspecified phase) |
0.8145 | Intermediate Similarity | NPD1548 | Phase 1 |
0.8102 | Intermediate Similarity | NPD1652 | Phase 2 |
0.8099 | Intermediate Similarity | NPD5535 | Approved |
0.808 | Intermediate Similarity | NPD5691 | Approved |
0.8074 | Intermediate Similarity | NPD3748 | Approved |
0.8058 | Intermediate Similarity | NPD643 | Clinical (unspecified phase) |
0.8051 | Intermediate Similarity | NPD3134 | Approved |
0.8015 | Intermediate Similarity | NPD2796 | Approved |
0.7983 | Intermediate Similarity | NPD1358 | Approved |
0.7958 | Intermediate Similarity | NPD920 | Approved |
0.7943 | Intermediate Similarity | NPD642 | Clinical (unspecified phase) |
0.7923 | Intermediate Similarity | NPD2797 | Approved |
0.7895 | Intermediate Similarity | NPD4907 | Clinical (unspecified phase) |
0.7891 | Intermediate Similarity | NPD1610 | Phase 2 |
0.7874 | Intermediate Similarity | NPD4626 | Approved |
0.7786 | Intermediate Similarity | NPD3750 | Approved |
0.7786 | Intermediate Similarity | NPD3266 | Approved |
0.7786 | Intermediate Similarity | NPD3267 | Approved |
0.7746 | Intermediate Similarity | NPD6799 | Approved |
0.7744 | Intermediate Similarity | NPD4908 | Phase 1 |
0.7744 | Intermediate Similarity | NPD6832 | Phase 2 |
0.7742 | Intermediate Similarity | NPD1241 | Discontinued |
0.774 | Intermediate Similarity | NPD7411 | Suspended |
0.7714 | Intermediate Similarity | NPD7421 | Clinical (unspecified phase) |
0.771 | Intermediate Similarity | NPD3225 | Approved |
0.7692 | Intermediate Similarity | NPD4378 | Clinical (unspecified phase) |
0.7687 | Intermediate Similarity | NPD6801 | Discontinued |
0.766 | Intermediate Similarity | NPD6398 | Clinical (unspecified phase) |
0.7647 | Intermediate Similarity | NPD1240 | Approved |
0.7635 | Intermediate Similarity | NPD7096 | Clinical (unspecified phase) |
0.7635 | Intermediate Similarity | NPD7819 | Suspended |
0.763 | Intermediate Similarity | NPD3268 | Approved |
0.7615 | Intermediate Similarity | NPD1611 | Approved |
0.7569 | Intermediate Similarity | NPD7410 | Clinical (unspecified phase) |
0.7557 | Intermediate Similarity | NPD9717 | Approved |
0.7556 | Intermediate Similarity | NPD4625 | Phase 3 |
0.7551 | Intermediate Similarity | NPD6599 | Discontinued |
0.755 | Intermediate Similarity | NPD919 | Approved |
0.7538 | Intermediate Similarity | NPD3496 | Discontinued |
0.7536 | Intermediate Similarity | NPD1607 | Approved |
0.7534 | Intermediate Similarity | NPD1653 | Approved |
0.7533 | Intermediate Similarity | NPD7768 | Phase 2 |
0.7518 | Intermediate Similarity | NPD4307 | Phase 2 |
0.7518 | Intermediate Similarity | NPD970 | Clinical (unspecified phase) |
0.7518 | Intermediate Similarity | NPD1549 | Phase 2 |
0.75 | Intermediate Similarity | NPD4749 | Approved |
0.75 | Intermediate Similarity | NPD1551 | Phase 2 |
0.7483 | Intermediate Similarity | NPD7075 | Discontinued |
0.7483 | Intermediate Similarity | NPD8158 | Clinical (unspecified phase) |
0.748 | Intermediate Similarity | NPD2684 | Approved |
0.7463 | Intermediate Similarity | NPD1019 | Discontinued |
0.7462 | Intermediate Similarity | NPD1778 | Approved |
0.7462 | Intermediate Similarity | NPD17 | Approved |
0.7447 | Intermediate Similarity | NPD1550 | Clinical (unspecified phase) |
0.7447 | Intermediate Similarity | NPD1552 | Clinical (unspecified phase) |
0.7429 | Intermediate Similarity | NPD1510 | Phase 2 |
0.7429 | Intermediate Similarity | NPD2799 | Discontinued |
0.7417 | Intermediate Similarity | NPD940 | Approved |
0.7417 | Intermediate Similarity | NPD846 | Approved |
0.7391 | Intermediate Similarity | NPD4060 | Phase 1 |
0.7388 | Intermediate Similarity | NPD1203 | Approved |
0.7383 | Intermediate Similarity | NPD7615 | Clinical (unspecified phase) |
0.7376 | Intermediate Similarity | NPD2935 | Discontinued |
0.7372 | Intermediate Similarity | NPD6410 | Clinical (unspecified phase) |
0.7353 | Intermediate Similarity | NPD1529 | Clinical (unspecified phase) |
0.7347 | Intermediate Similarity | NPD5403 | Approved |
0.7338 | Intermediate Similarity | NPD4340 | Discontinued |
0.7329 | Intermediate Similarity | NPD5401 | Approved |
0.7313 | Intermediate Similarity | NPD8651 | Approved |
0.731 | Intermediate Similarity | NPD6666 | Approved |
0.731 | Intermediate Similarity | NPD6667 | Approved |
0.7305 | Intermediate Similarity | NPD4308 | Phase 3 |
0.7305 | Intermediate Similarity | NPD7033 | Discontinued |
0.7293 | Intermediate Similarity | NPD1608 | Approved |
0.7292 | Intermediate Similarity | NPD1878 | Clinical (unspecified phase) |
0.7279 | Intermediate Similarity | NPD1530 | Clinical (unspecified phase) |
0.7279 | Intermediate Similarity | NPD7314 | Clinical (unspecified phase) |
0.7266 | Intermediate Similarity | NPD1613 | Approved |
0.7266 | Intermediate Similarity | NPD1612 | Clinical (unspecified phase) |
0.726 | Intermediate Similarity | NPD7837 | Clinical (unspecified phase) |
0.7258 | Intermediate Similarity | NPD290 | Approved |
0.7246 | Intermediate Similarity | NPD2313 | Discontinued |
0.7246 | Intermediate Similarity | NPD6798 | Discontinued |
0.7244 | Intermediate Similarity | NPD7843 | Approved |
0.7237 | Intermediate Similarity | NPD3817 | Phase 2 |
0.7218 | Intermediate Similarity | NPD1091 | Approved |
0.7218 | Intermediate Similarity | NPD1281 | Approved |
0.7218 | Intermediate Similarity | NPD1547 | Clinical (unspecified phase) |
0.7214 | Intermediate Similarity | NPD1899 | Clinical (unspecified phase) |
0.7206 | Intermediate Similarity | NPD6917 | Clinical (unspecified phase) |
0.72 | Intermediate Similarity | NPD4380 | Phase 2 |
0.7197 | Intermediate Similarity | NPD7852 | Clinical (unspecified phase) |
0.7176 | Intermediate Similarity | NPD9545 | Approved |
0.7176 | Intermediate Similarity | NPD1894 | Discontinued |
0.7172 | Intermediate Similarity | NPD4628 | Phase 3 |
0.7171 | Intermediate Similarity | NPD2393 | Clinical (unspecified phase) |
0.717 | Intermediate Similarity | NPD5844 | Phase 1 |
0.7165 | Intermediate Similarity | NPD1139 | Approved |
0.7165 | Intermediate Similarity | NPD1137 | Approved |
0.7162 | Intermediate Similarity | NPD1940 | Clinical (unspecified phase) |
0.7153 | Intermediate Similarity | NPD3018 | Phase 2 |
0.7153 | Intermediate Similarity | NPD2424 | Discontinued |
0.7143 | Intermediate Similarity | NPD4140 | Approved |
0.7143 | Intermediate Similarity | NPD3847 | Discontinued |
0.7143 | Intermediate Similarity | NPD5451 | Approved |
0.7133 | Intermediate Similarity | NPD4476 | Approved |
0.7133 | Intermediate Similarity | NPD4477 | Approved |
0.7124 | Intermediate Similarity | NPD8443 | Clinical (unspecified phase) |
0.7124 | Intermediate Similarity | NPD4288 | Approved |
0.7121 | Intermediate Similarity | NPD1651 | Approved |
0.7121 | Intermediate Similarity | NPD5585 | Approved |
0.7114 | Intermediate Similarity | NPD6980 | Clinical (unspecified phase) |
0.7113 | Intermediate Similarity | NPD2200 | Suspended |
0.7109 | Intermediate Similarity | NPD1138 | Approved |
0.7109 | Intermediate Similarity | NPD821 | Approved |
0.7099 | Intermediate Similarity | NPD7644 | Approved |
0.7095 | Intermediate Similarity | NPD2533 | Approved |
0.7095 | Intermediate Similarity | NPD2532 | Approved |
0.7095 | Intermediate Similarity | NPD2534 | Approved |
0.7092 | Intermediate Similarity | NPD6355 | Discontinued |
0.7092 | Intermediate Similarity | NPD1933 | Approved |
0.7083 | Intermediate Similarity | NPD6002 | Phase 3 |
0.7083 | Intermediate Similarity | NPD6003 | Clinical (unspecified phase) |
0.7083 | Intermediate Similarity | NPD6005 | Phase 3 |
0.7083 | Intermediate Similarity | NPD6004 | Phase 3 |
0.7083 | Intermediate Similarity | NPD6006 | Clinical (unspecified phase) |
0.708 | Intermediate Similarity | NPD3690 | Phase 2 |
0.708 | Intermediate Similarity | NPD3691 | Phase 2 |
0.7078 | Intermediate Similarity | NPD4868 | Clinical (unspecified phase) |
0.7077 | Intermediate Similarity | NPD6671 | Approved |
0.7077 | Intermediate Similarity | NPD7157 | Approved |
0.7077 | Intermediate Similarity | NPD2557 | Approved |
0.7071 | Intermediate Similarity | NPD8032 | Phase 2 |
0.7059 | Intermediate Similarity | NPD1283 | Approved |
0.7055 | Intermediate Similarity | NPD7466 | Approved |
0.7054 | Intermediate Similarity | NPD594 | Approved |
0.7054 | Intermediate Similarity | NPD592 | Approved |
0.7051 | Intermediate Similarity | NPD5494 | Approved |
0.705 | Intermediate Similarity | NPD3027 | Phase 3 |
0.7037 | Intermediate Similarity | NPD2981 | Phase 2 |
0.7037 | Intermediate Similarity | NPD3972 | Approved |
0.7032 | Intermediate Similarity | NPD3749 | Approved |
0.7032 | Intermediate Similarity | NPD4381 | Clinical (unspecified phase) |
0.7029 | Intermediate Similarity | NPD2237 | Approved |
0.7029 | Intermediate Similarity | NPD2861 | Phase 2 |
0.7027 | Intermediate Similarity | NPD7213 | Phase 3 |
0.7027 | Intermediate Similarity | NPD7212 | Phase 2 |
0.7027 | Intermediate Similarity | NPD1511 | Approved |
0.7023 | Intermediate Similarity | NPD3596 | Phase 2 |
0.7023 | Intermediate Similarity | NPD9493 | Approved |
0.7014 | Intermediate Similarity | NPD6099 | Approved |
0.7014 | Intermediate Similarity | NPD6100 | Approved |
0.7013 | Intermediate Similarity | NPD5402 | Approved |
0.7006 | Intermediate Similarity | NPD1247 | Approved |
0.7 | Intermediate Similarity | NPD411 | Approved |
0.6993 | Remote Similarity | NPD7097 | Phase 1 |
0.6986 | Remote Similarity | NPD2800 | Approved |
0.6985 | Remote Similarity | NPD2983 | Phase 2 |
0.6985 | Remote Similarity | NPD2982 | Phase 2 |
0.698 | Remote Similarity | NPD7447 | Phase 1 |
0.6975 | Remote Similarity | NPD5953 | Discontinued |
0.6972 | Remote Similarity | NPD447 | Suspended |
0.697 | Remote Similarity | NPD5536 | Phase 2 |
0.6966 | Remote Similarity | NPD2343 | Clinical (unspecified phase) |
0.6966 | Remote Similarity | NPD5762 | Approved |
0.6966 | Remote Similarity | NPD5763 | Approved |
0.6963 | Remote Similarity | NPD1535 | Discovery |
0.6962 | Remote Similarity | NPD7229 | Phase 3 |
0.6957 | Remote Similarity | NPD2798 | Approved |
0.6957 | Remote Similarity | NPD7286 | Phase 2 |
0.695 | Remote Similarity | NPD6233 | Phase 2 |
0.6948 | Remote Similarity | NPD2801 | Approved |
0.6947 | Remote Similarity | NPD6387 | Discontinued |
0.6939 | Remote Similarity | NPD7003 | Approved |
0.6933 | Remote Similarity | NPD1512 | Approved |
0.6929 | Remote Similarity | NPD7095 | Approved |
0.6929 | Remote Similarity | NPD5163 | Phase 2 |
0.6923 | Remote Similarity | NPD6651 | Approved |
0.6923 | Remote Similarity | NPD1772 | Clinical (unspecified phase) |
0.6923 | Remote Similarity | NPD5283 | Phase 1 |
0.6923 | Remote Similarity | NPD6971 | Discontinued |
0.6917 | Remote Similarity | NPD6581 | Approved |
0.6917 | Remote Similarity | NPD6580 | Approved |
0.6912 | Remote Similarity | NPD1481 | Phase 2 |
0.6908 | Remote Similarity | NPD3226 | Approved |
0.6905 | Remote Similarity | NPD968 | Approved |
0.6901 | Remote Similarity | NPD2979 | Phase 3 |
0.689 | Remote Similarity | NPD7549 | Discontinued |
0.6884 | Remote Similarity | NPD987 | Approved |
0.6883 | Remote Similarity | NPD1934 | Approved |
0.6879 | Remote Similarity | NPD3374 | Clinical (unspecified phase) |
0.6879 | Remote Similarity | NPD1048 | Approved |
PubChem CID   | 10228 |
ChEMBL   | CHEMBL52229 |
ZINC   |
Molecular Weight:   | 244.11 |
ALogP:   | 2.0956 |
MLogP:   | 2.78 |
XLogP:   | 3.521 |
# Rotatable Bonds:   | 6 |
Polar Surface Area:   | 35.53 |
# H-Bond Aceptor:   | 1 |
# H-Bond Donor:   | 0 |
# Rings:   | 2 |
# Heavy Atoms:   | 18 |