Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO9241 | Adiantum capillus-veneris | Species | Pteridaceae | Eukaryota | UNPD* | |||
NPO24124 | Curcuma longa | Species | Zingiberaceae | Eukaryota | TM-MC* | |||
NPO16101 | Gleditsia triacanthos | Species | Fabaceae | Eukaryota | TCMID* | |||
NPO7191 | Mimosa pudica | Species | Fabaceae | Eukaryota | TCMID* | |||
NPO7929 | Curcuma zedoaria | Species | Zingiberaceae | Eukaryota | TCMID* | |||
NPO1079 | Vachellia karroo | Species | Fabaceae | Eukaryota | TCMID* | |||
NPO3634 | Robinia pseudoacacia | Species | Fabaceae | Eukaryota | TCMID* | |||
NPO19855 | Oxalis acetosella | Species | Oxalidaceae | Eukaryota | TCMID* | |||
NPO24124 | Curcuma longa | Species | Zingiberaceae | Eukaryota | TCMID* | |||
NPO25209 | Curcuma aromatica | Species | Zingiberaceae | Eukaryota | TCMID* | |||
NPO3532 | Tridentata marginata | NA | NA | NA | UNPD* | |||
NPO24124 | Curcuma longa | Species | Zingiberaceae | Eukaryota | rhizome |
PMID[12617587] |
||
NPO3251 | Jacobaea maritima | Species | Asteraceae | Eukaryota | UNPD* | |||
NPO7308 | Fraxinus quadrangulata | Species | Oleaceae | Eukaryota | UNPD* | |||
NPO16101 | Gleditsia triacanthos | Species | Fabaceae | Eukaryota | HerDing* | |||
NPO19855 | Oxalis acetosella | Species | Oxalidaceae | Eukaryota | HerDing* | |||
NPO24124 | Curcuma longa | Species | Zingiberaceae | Eukaryota | HerDing* | |||
NPO25209 | Curcuma aromatica | Species | Zingiberaceae | Eukaryota | HerDing* | |||
NPO30920 | Acacia karroo | Species | Fabaceae | Eukaryota | HerDing* | |||
NPO3634 | Robinia pseudoacacia | Species | Fabaceae | Eukaryota | HerDing* | |||
NPO7191 | Mimosa pudica | Species | Fabaceae | Eukaryota | HerDing* | |||
NPO7929 | Curcuma zedoaria | Species | Zingiberaceae | Eukaryota | HerDing* | |||
NPO25160 | Goniothalamus borneensis | Species | Annonaceae | Eukaryota | UNPD* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT2564 | Organism | Blumeria graminis | Blumeria graminis | Activity | = | 0 | % | 12617587 |
NPT829 | Organism | Puccinia recondita | Puccinia recondita | Activity | = | 0 | % | 12617587 |
NPT825 | Organism | Phytophthora infestans | Phytophthora infestans | Activity | = | 0 | % | 12617587 |
NPT635 | Organism | Botryotinia fuckeliana | Botryotinia fuckeliana | Activity | = | 0 | % | 12617587 |
NPT529 | Organism | Rhizoctonia solani | Rhizoctonia solani | Activity | = | 0 | % | 12617587 |
NPT1198 | Organism | Magnaporthe grisea | Magnaporthe grisea | Activity | = | 0 | % | 12617587 |
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 NPC32351 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 |
---|---|---|
0.9388 | High Similarity | NPC268564 |
0.9167 | High Similarity | NPC163984 |
0.9167 | High Similarity | NPC176819 |
0.9167 | High Similarity | NPC58970 |
0.9149 | High Similarity | NPC91962 |
0.898 | High Similarity | NPC64866 |
0.8936 | High Similarity | NPC14917 |
0.8936 | High Similarity | NPC236355 |
0.8936 | High Similarity | NPC4079 |
0.8913 | High Similarity | NPC25771 |
0.8846 | High Similarity | NPC473733 |
0.8696 | High Similarity | NPC292463 |
0.8542 | High Similarity | NPC262558 |
0.8542 | High Similarity | NPC8610 |
0.8519 | High Similarity | NPC311852 |
0.8364 | Intermediate Similarity | NPC276764 |
0.8364 | Intermediate Similarity | NPC472304 |
0.8333 | Intermediate Similarity | NPC166788 |
0.8302 | Intermediate Similarity | NPC275472 |
0.8269 | Intermediate Similarity | NPC45283 |
0.8269 | Intermediate Similarity | NPC23117 |
0.8269 | Intermediate Similarity | NPC474141 |
0.8269 | Intermediate Similarity | NPC37644 |
0.8235 | Intermediate Similarity | NPC27438 |
0.8214 | Intermediate Similarity | NPC127582 |
0.8182 | Intermediate Similarity | NPC308108 |
0.8182 | Intermediate Similarity | NPC56905 |
0.8182 | Intermediate Similarity | NPC27610 |
0.8182 | Intermediate Similarity | NPC170799 |
0.8113 | Intermediate Similarity | NPC209431 |
0.8113 | Intermediate Similarity | NPC100809 |
0.8077 | Intermediate Similarity | NPC471751 |
0.807 | Intermediate Similarity | NPC213152 |
0.8039 | Intermediate Similarity | NPC228776 |
0.8 | Intermediate Similarity | NPC193695 |
0.8 | Intermediate Similarity | NPC115385 |
0.7959 | Intermediate Similarity | NPC191337 |
0.7931 | Intermediate Similarity | NPC165695 |
0.7925 | Intermediate Similarity | NPC14002 |
0.7917 | Intermediate Similarity | NPC301972 |
0.7857 | Intermediate Similarity | NPC94991 |
0.7857 | Intermediate Similarity | NPC266295 |
0.7843 | Intermediate Similarity | NPC145311 |
0.7818 | Intermediate Similarity | NPC20603 |
0.78 | Intermediate Similarity | NPC276009 |
0.78 | Intermediate Similarity | NPC195246 |
0.78 | Intermediate Similarity | NPC22098 |
0.78 | Intermediate Similarity | NPC100380 |
0.7797 | Intermediate Similarity | NPC6697 |
0.7797 | Intermediate Similarity | NPC475124 |
0.7797 | Intermediate Similarity | NPC212210 |
0.7797 | Intermediate Similarity | NPC285371 |
0.7797 | Intermediate Similarity | NPC150162 |
0.7778 | Intermediate Similarity | NPC202850 |
0.7778 | Intermediate Similarity | NPC5626 |
0.7778 | Intermediate Similarity | NPC63396 |
0.7755 | Intermediate Similarity | NPC477686 |
0.7719 | Intermediate Similarity | NPC285594 |
0.7719 | Intermediate Similarity | NPC259261 |
0.7719 | Intermediate Similarity | NPC143834 |
0.7719 | Intermediate Similarity | NPC96551 |
0.7692 | Intermediate Similarity | NPC116906 |
0.7692 | Intermediate Similarity | NPC15325 |
0.7692 | Intermediate Similarity | NPC118788 |
0.7667 | Intermediate Similarity | NPC251118 |
0.7627 | Intermediate Similarity | NPC32285 |
0.7627 | Intermediate Similarity | NPC288253 |
0.7593 | Intermediate Similarity | NPC296311 |
0.7586 | Intermediate Similarity | NPC25853 |
0.7544 | Intermediate Similarity | NPC30215 |
0.75 | Intermediate Similarity | NPC4638 |
0.7458 | Intermediate Similarity | NPC97322 |
0.7451 | Intermediate Similarity | NPC471752 |
0.7419 | Intermediate Similarity | NPC475523 |
0.7391 | Intermediate Similarity | NPC185839 |
0.7377 | Intermediate Similarity | NPC470329 |
0.7368 | Intermediate Similarity | NPC192427 |
0.7368 | Intermediate Similarity | NPC49575 |
0.7368 | Intermediate Similarity | NPC267626 |
0.7368 | Intermediate Similarity | NPC55004 |
0.7368 | Intermediate Similarity | NPC230823 |
0.7333 | Intermediate Similarity | NPC197238 |
0.7333 | Intermediate Similarity | NPC167256 |
0.7333 | Intermediate Similarity | NPC202118 |
0.7321 | Intermediate Similarity | NPC188789 |
0.7302 | Intermediate Similarity | NPC260474 |
0.7302 | Intermediate Similarity | NPC188292 |
0.7302 | Intermediate Similarity | NPC310992 |
0.7302 | Intermediate Similarity | NPC155198 |
0.7302 | Intermediate Similarity | NPC87141 |
0.7292 | Intermediate Similarity | NPC111474 |
0.7292 | Intermediate Similarity | NPC113082 |
0.7273 | Intermediate Similarity | NPC69898 |
0.7273 | Intermediate Similarity | NPC295777 |
0.7234 | Intermediate Similarity | NPC155880 |
0.7234 | Intermediate Similarity | NPC92863 |
0.7234 | Intermediate Similarity | NPC180840 |
0.7222 | Intermediate Similarity | NPC236623 |
0.7213 | Intermediate Similarity | NPC473902 |
0.7213 | Intermediate Similarity | NPC469662 |
0.72 | Intermediate Similarity | NPC216921 |
0.72 | Intermediate Similarity | NPC106819 |
0.7188 | Intermediate Similarity | NPC256846 |
0.7188 | Intermediate Similarity | NPC469914 |
0.7188 | Intermediate Similarity | NPC474060 |
0.7188 | Intermediate Similarity | NPC139397 |
0.7174 | Intermediate Similarity | NPC38497 |
0.7167 | Intermediate Similarity | NPC475795 |
0.7167 | Intermediate Similarity | NPC60565 |
0.7143 | Intermediate Similarity | NPC250539 |
0.7091 | Intermediate Similarity | NPC216407 |
0.7083 | Intermediate Similarity | NPC217923 |
0.7077 | Intermediate Similarity | NPC35734 |
0.7077 | Intermediate Similarity | NPC2634 |
0.7077 | Intermediate Similarity | NPC260040 |
0.7077 | Intermediate Similarity | NPC307176 |
0.7077 | Intermediate Similarity | NPC159577 |
0.7077 | Intermediate Similarity | NPC265782 |
0.7077 | Intermediate Similarity | NPC282593 |
0.7077 | Intermediate Similarity | NPC251929 |
0.7059 | Intermediate Similarity | NPC114841 |
0.7021 | Intermediate Similarity | NPC190810 |
0.7021 | Intermediate Similarity | NPC34764 |
0.7021 | Intermediate Similarity | NPC76145 |
0.7018 | Intermediate Similarity | NPC200258 |
0.6981 | Remote Similarity | NPC324812 |
0.697 | Remote Similarity | NPC181204 |
0.697 | Remote Similarity | NPC54123 |
0.697 | Remote Similarity | NPC474562 |
0.697 | Remote Similarity | NPC115023 |
0.697 | Remote Similarity | NPC190035 |
0.6949 | Remote Similarity | NPC60772 |
0.6923 | Remote Similarity | NPC136473 |
0.6909 | Remote Similarity | NPC234829 |
0.6909 | Remote Similarity | NPC30433 |
0.6909 | Remote Similarity | NPC477458 |
0.6875 | Remote Similarity | NPC139717 |
0.6875 | Remote Similarity | NPC297643 |
0.6875 | Remote Similarity | NPC290350 |
0.6875 | Remote Similarity | NPC4370 |
0.6875 | Remote Similarity | NPC269985 |
0.6875 | Remote Similarity | NPC229262 |
0.6866 | Remote Similarity | NPC470045 |
0.6866 | Remote Similarity | NPC109576 |
0.6866 | Remote Similarity | NPC56747 |
0.6866 | Remote Similarity | NPC130016 |
0.6866 | Remote Similarity | NPC276336 |
0.6866 | Remote Similarity | NPC470044 |
0.6866 | Remote Similarity | NPC186042 |
0.6866 | Remote Similarity | NPC180015 |
0.6866 | Remote Similarity | NPC474228 |
0.6866 | Remote Similarity | NPC303613 |
0.6866 | Remote Similarity | NPC251705 |
0.6842 | Remote Similarity | NPC95581 |
0.6833 | Remote Similarity | NPC473494 |
0.6825 | Remote Similarity | NPC61473 |
0.6825 | Remote Similarity | NPC474304 |
0.6825 | Remote Similarity | NPC474329 |
0.6818 | Remote Similarity | NPC151045 |
0.6818 | Remote Similarity | NPC246722 |
0.6786 | Remote Similarity | NPC22182 |
0.678 | Remote Similarity | NPC165808 |
0.6774 | Remote Similarity | NPC477707 |
0.6774 | Remote Similarity | NPC477830 |
0.6774 | Remote Similarity | NPC57463 |
0.6774 | Remote Similarity | NPC151728 |
0.6774 | Remote Similarity | NPC472306 |
0.6774 | Remote Similarity | NPC190049 |
0.6774 | Remote Similarity | NPC322457 |
0.6769 | Remote Similarity | NPC142754 |
0.6769 | Remote Similarity | NPC469679 |
0.6769 | Remote Similarity | NPC82477 |
0.6769 | Remote Similarity | NPC20610 |
0.6769 | Remote Similarity | NPC39157 |
0.6769 | Remote Similarity | NPC469688 |
0.6769 | Remote Similarity | NPC296697 |
0.6765 | Remote Similarity | NPC215050 |
0.6765 | Remote Similarity | NPC309852 |
0.6739 | Remote Similarity | NPC12889 |
0.6731 | Remote Similarity | NPC471753 |
0.6727 | Remote Similarity | NPC474391 |
0.6719 | Remote Similarity | NPC100719 |
0.6719 | Remote Similarity | NPC323005 |
0.6719 | Remote Similarity | NPC166791 |
0.6719 | Remote Similarity | NPC322035 |
0.6719 | Remote Similarity | NPC197089 |
0.6716 | Remote Similarity | NPC234707 |
0.6716 | Remote Similarity | NPC133253 |
0.6716 | Remote Similarity | NPC225467 |
0.6716 | Remote Similarity | NPC5701 |
0.6716 | Remote Similarity | NPC21944 |
0.6667 | Remote Similarity | NPC65650 |
0.6667 | Remote Similarity | NPC476346 |
0.6667 | Remote Similarity | NPC114236 |
0.6667 | Remote Similarity | NPC477449 |
0.6667 | Remote Similarity | NPC474400 |
0.6667 | Remote Similarity | NPC182815 |
0.6667 | Remote Similarity | NPC473171 |
0.6667 | Remote Similarity | NPC477448 |
0.6667 | Remote Similarity | NPC293803 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC32351 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 |
---|---|---|---|
0.8182 | Intermediate Similarity | NPD287 | Approved |
0.7258 | Intermediate Similarity | NPD7331 | Phase 2 |
0.7188 | Intermediate Similarity | NPD4137 | Phase 3 |
0.7083 | Intermediate Similarity | NPD5783 | Phase 3 |
0.7077 | Intermediate Similarity | NPD4747 | Approved |
0.7077 | Intermediate Similarity | NPD4691 | Approved |
0.7021 | Intermediate Similarity | NPD319 | Phase 1 |
0.697 | Remote Similarity | NPD5276 | Approved |
0.6825 | Remote Similarity | NPD7341 | Phase 2 |
0.6769 | Remote Similarity | NPD3621 | Clinical (unspecified phase) |
0.6765 | Remote Similarity | NPD4687 | Approved |
0.6765 | Remote Similarity | NPD5733 | Approved |
0.6765 | Remote Similarity | NPD4058 | Approved |
0.6724 | Remote Similarity | NPD4627 | Clinical (unspecified phase) |
0.6508 | Remote Similarity | NPD2664 | Clinical (unspecified phase) |
0.6462 | Remote Similarity | NPD6108 | Clinical (unspecified phase) |
0.623 | Remote Similarity | NPD8779 | Phase 3 |
0.6216 | Remote Similarity | NPD4695 | Discontinued |
0.6094 | Remote Similarity | NPD4193 | Approved |
0.6094 | Remote Similarity | NPD4191 | Approved |
0.6094 | Remote Similarity | NPD4194 | Approved |
0.6094 | Remote Similarity | NPD4192 | Approved |
0.6053 | Remote Similarity | NPD4223 | Phase 3 |
0.6053 | Remote Similarity | NPD4221 | Approved |
0.6 | Remote Similarity | NPD3174 | Discontinued |
0.6 | Remote Similarity | NPD8259 | Clinical (unspecified phase) |
0.5974 | Remote Similarity | NPD3527 | Clinical (unspecified phase) |
0.5921 | Remote Similarity | NPD8028 | Phase 2 |
0.5902 | Remote Similarity | NPD342 | Phase 1 |
0.5897 | Remote Similarity | NPD3666 | Approved |
0.5897 | Remote Similarity | NPD4197 | Approved |
0.5897 | Remote Similarity | NPD3133 | Approved |
0.5897 | Remote Similarity | NPD3665 | Phase 1 |
0.5823 | Remote Similarity | NPD5329 | Approved |
0.5763 | Remote Similarity | NPD29 | Approved |
0.5763 | Remote Similarity | NPD28 | Approved |
0.575 | Remote Similarity | NPD5690 | Phase 2 |
0.575 | Remote Similarity | NPD6684 | Approved |
0.575 | Remote Similarity | NPD4689 | Approved |
0.575 | Remote Similarity | NPD7521 | Approved |
0.575 | Remote Similarity | NPD4693 | Phase 3 |
0.575 | Remote Similarity | NPD6409 | Approved |
0.575 | Remote Similarity | NPD3618 | Phase 1 |
0.575 | Remote Similarity | NPD4519 | Discontinued |
0.575 | Remote Similarity | NPD7146 | Approved |
0.575 | Remote Similarity | NPD4623 | Approved |
0.575 | Remote Similarity | NPD4690 | Approved |
0.575 | Remote Similarity | NPD4138 | Approved |
0.575 | Remote Similarity | NPD5330 | Approved |
0.575 | Remote Similarity | NPD5279 | Phase 3 |
0.575 | Remote Similarity | NPD4694 | Approved |
0.575 | Remote Similarity | NPD5205 | Approved |
0.575 | Remote Similarity | NPD5280 | Approved |
0.575 | Remote Similarity | NPD4688 | Approved |
0.575 | Remote Similarity | NPD7334 | Approved |
0.5738 | Remote Similarity | NPD539 | Approved |
0.5735 | Remote Similarity | NPD3704 | Approved |
0.5733 | Remote Similarity | NPD3617 | Approved |
0.569 | Remote Similarity | NPD3173 | Approved |
0.5679 | Remote Similarity | NPD3573 | Approved |
0.5652 | Remote Similarity | NPD3709 | Clinical (unspecified phase) |
0.5641 | Remote Similarity | NPD3667 | Approved |
0.5625 | Remote Similarity | NPD1694 | Approved |
0.561 | Remote Similarity | NPD5208 | Approved |
0.561 | Remote Similarity | NPD6903 | Approved |
0.561 | Remote Similarity | NPD7513 | Clinical (unspecified phase) |
0.561 | Remote Similarity | NPD6672 | Approved |
0.561 | Remote Similarity | NPD5737 | Approved |
0.561 | Remote Similarity | NPD4518 | Approved |
0.5606 | Remote Similarity | NPD368 | Approved |
0.56 | Remote Similarity | NPD4756 | Discovery |
PubChem CID   | 14367555 |
ChEMBL   | CHEMBL2272665 |
ZINC   |
Molecular Weight:   | 218.17 |
ALogP:   | 3.1827 |
MLogP:   | 3 |
XLogP:   | 3.687 |
# Rotatable Bonds:   | 8 |
Polar Surface Area:   | 17.07 |
# H-Bond Aceptor:   | 1 |
# H-Bond Donor:   | 0 |
# Rings:   | 1 |
# Heavy Atoms:   | 16 |