Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO28807 | Laggera pterodonta | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO6212 | Myrrha | Species | Coccinellidae | Eukaryota | TCMSP* | |||
NPO18840 | Platycladi cacumen | NA | NA | NA | TCMSP* | |||
NPO13103 | Radix angelicae biseratae | Species | Lymnaeidae | Eukaryota | TCMSP* | |||
NPO20440 | Chrysanthemum x morifolium | Species | Asteraceae | Eukaryota | TM-MC* |
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 NPC95581 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 |
---|---|---|
0.86 | High Similarity | NPC195246 |
0.86 | High Similarity | NPC22098 |
0.86 | High Similarity | NPC276009 |
0.8 | Intermediate Similarity | NPC106819 |
0.7759 | Intermediate Similarity | NPC267626 |
0.7759 | Intermediate Similarity | NPC55004 |
0.7759 | Intermediate Similarity | NPC49575 |
0.7538 | Intermediate Similarity | NPC61702 |
0.7538 | Intermediate Similarity | NPC162867 |
0.746 | Intermediate Similarity | NPC183422 |
0.7458 | Intermediate Similarity | NPC230823 |
0.7385 | Intermediate Similarity | NPC469679 |
0.7377 | Intermediate Similarity | NPC25853 |
0.7333 | Intermediate Similarity | NPC30215 |
0.7333 | Intermediate Similarity | NPC94991 |
0.7333 | Intermediate Similarity | NPC266295 |
0.7313 | Intermediate Similarity | NPC304983 |
0.7241 | Intermediate Similarity | NPC209431 |
0.7241 | Intermediate Similarity | NPC100809 |
0.7213 | Intermediate Similarity | NPC259261 |
0.7193 | Intermediate Similarity | NPC22182 |
0.7188 | Intermediate Similarity | NPC268039 |
0.717 | Intermediate Similarity | NPC114841 |
0.7143 | Intermediate Similarity | NPC165695 |
0.7119 | Intermediate Similarity | NPC188789 |
0.7031 | Intermediate Similarity | NPC473902 |
0.7018 | Intermediate Similarity | NPC30433 |
0.7018 | Intermediate Similarity | NPC27438 |
0.7015 | Intermediate Similarity | NPC469677 |
0.7 | Intermediate Similarity | NPC252860 |
0.7 | Intermediate Similarity | NPC20603 |
0.6984 | Remote Similarity | NPC213152 |
0.6984 | Remote Similarity | NPC97322 |
0.6984 | Remote Similarity | NPC475795 |
0.697 | Remote Similarity | NPC290350 |
0.697 | Remote Similarity | NPC4370 |
0.697 | Remote Similarity | NPC193770 |
0.6949 | Remote Similarity | NPC250539 |
0.6901 | Remote Similarity | NPC215481 |
0.6897 | Remote Similarity | NPC216407 |
0.6875 | Remote Similarity | NPC167256 |
0.6866 | Remote Similarity | NPC469688 |
0.6866 | Remote Similarity | NPC155198 |
0.6842 | Remote Similarity | NPC32351 |
0.6786 | Remote Similarity | NPC91962 |
0.678 | Remote Similarity | NPC296311 |
0.678 | Remote Similarity | NPC45283 |
0.678 | Remote Similarity | NPC268564 |
0.678 | Remote Similarity | NPC474141 |
0.6774 | Remote Similarity | NPC311852 |
0.6769 | Remote Similarity | NPC212210 |
0.6769 | Remote Similarity | NPC169275 |
0.6769 | Remote Similarity | NPC52449 |
0.6761 | Remote Similarity | NPC469669 |
0.6761 | Remote Similarity | NPC469678 |
0.6761 | Remote Similarity | NPC475771 |
0.6727 | Remote Similarity | NPC239754 |
0.6724 | Remote Similarity | NPC64866 |
0.6724 | Remote Similarity | NPC234829 |
0.6714 | Remote Similarity | NPC107783 |
0.6714 | Remote Similarity | NPC92909 |
0.6712 | Remote Similarity | NPC228911 |
0.6667 | Remote Similarity | NPC143834 |
0.6667 | Remote Similarity | NPC469796 |
0.6667 | Remote Similarity | NPC202850 |
0.6667 | Remote Similarity | NPC96551 |
0.6667 | Remote Similarity | NPC469793 |
0.6667 | Remote Similarity | NPC285594 |
0.6667 | Remote Similarity | NPC63396 |
0.6622 | Remote Similarity | NPC90965 |
0.6622 | Remote Similarity | NPC170793 |
0.6622 | Remote Similarity | NPC261125 |
0.6622 | Remote Similarity | NPC181195 |
0.6618 | Remote Similarity | NPC20610 |
0.6615 | Remote Similarity | NPC32285 |
0.6615 | Remote Similarity | NPC472306 |
0.6613 | Remote Similarity | NPC115385 |
0.661 | Remote Similarity | NPC170167 |
0.661 | Remote Similarity | NPC471751 |
0.6607 | Remote Similarity | NPC110234 |
0.6607 | Remote Similarity | NPC163751 |
0.6607 | Remote Similarity | NPC44363 |
0.6571 | Remote Similarity | NPC474562 |
0.6562 | Remote Similarity | NPC127582 |
0.6557 | Remote Similarity | NPC67367 |
0.6533 | Remote Similarity | NPC474509 |
0.6528 | Remote Similarity | NPC263698 |
0.6522 | Remote Similarity | NPC182815 |
0.6508 | Remote Similarity | NPC170799 |
0.6508 | Remote Similarity | NPC308108 |
0.65 | Remote Similarity | NPC23117 |
0.65 | Remote Similarity | NPC37644 |
0.6471 | Remote Similarity | NPC475523 |
0.6462 | Remote Similarity | NPC60565 |
0.6462 | Remote Similarity | NPC260573 |
0.6441 | Remote Similarity | NPC244452 |
0.6441 | Remote Similarity | NPC236623 |
0.6438 | Remote Similarity | NPC226242 |
0.6429 | Remote Similarity | NPC307176 |
0.6429 | Remote Similarity | NPC159577 |
0.6429 | Remote Similarity | NPC282593 |
0.6429 | Remote Similarity | NPC35734 |
0.6429 | Remote Similarity | NPC49088 |
0.6429 | Remote Similarity | NPC477856 |
0.6429 | Remote Similarity | NPC214770 |
0.6415 | Remote Similarity | NPC18205 |
0.6415 | Remote Similarity | NPC12319 |
0.6415 | Remote Similarity | NPC101147 |
0.6406 | Remote Similarity | NPC309825 |
0.6389 | Remote Similarity | NPC167049 |
0.6389 | Remote Similarity | NPC128346 |
0.6389 | Remote Similarity | NPC211641 |
0.6389 | Remote Similarity | NPC219232 |
0.6389 | Remote Similarity | NPC469691 |
0.6379 | Remote Similarity | NPC62755 |
0.6379 | Remote Similarity | NPC145311 |
0.6379 | Remote Similarity | NPC234597 |
0.6364 | Remote Similarity | NPC202118 |
0.6364 | Remote Similarity | NPC197238 |
0.6364 | Remote Similarity | NPC142683 |
0.6349 | Remote Similarity | NPC281986 |
0.6349 | Remote Similarity | NPC22019 |
0.6349 | Remote Similarity | NPC208749 |
0.6349 | Remote Similarity | NPC321568 |
0.6349 | Remote Similarity | NPC193695 |
0.6338 | Remote Similarity | NPC115023 |
0.6338 | Remote Similarity | NPC470078 |
0.6324 | Remote Similarity | NPC323005 |
0.6316 | Remote Similarity | NPC471752 |
0.6316 | Remote Similarity | NPC236355 |
0.6316 | Remote Similarity | NPC8610 |
0.6316 | Remote Similarity | NPC323445 |
0.6316 | Remote Similarity | NPC14917 |
0.6316 | Remote Similarity | NPC262558 |
0.6316 | Remote Similarity | NPC100380 |
0.6316 | Remote Similarity | NPC4079 |
0.6308 | Remote Similarity | NPC47840 |
0.6308 | Remote Similarity | NPC234264 |
0.6301 | Remote Similarity | NPC474011 |
0.629 | Remote Similarity | NPC200258 |
0.629 | Remote Similarity | NPC298299 |
0.629 | Remote Similarity | NPC275472 |
0.6286 | Remote Similarity | NPC139397 |
0.6286 | Remote Similarity | NPC256846 |
0.6282 | Remote Similarity | NPC470165 |
0.6282 | Remote Similarity | NPC474748 |
0.6271 | Remote Similarity | NPC289388 |
0.6271 | Remote Similarity | NPC116906 |
0.6271 | Remote Similarity | NPC163984 |
0.6271 | Remote Similarity | NPC58970 |
0.6271 | Remote Similarity | NPC176819 |
0.6269 | Remote Similarity | NPC469662 |
0.6269 | Remote Similarity | NPC475124 |
0.6269 | Remote Similarity | NPC285371 |
0.6269 | Remote Similarity | NPC6697 |
0.6267 | Remote Similarity | NPC82635 |
0.625 | Remote Similarity | NPC470044 |
0.625 | Remote Similarity | NPC251705 |
0.625 | Remote Similarity | NPC56905 |
0.625 | Remote Similarity | NPC474228 |
0.625 | Remote Similarity | NPC27610 |
0.625 | Remote Similarity | NPC470045 |
0.625 | Remote Similarity | NPC303613 |
0.623 | Remote Similarity | NPC14002 |
0.6216 | Remote Similarity | NPC469646 |
0.6216 | Remote Similarity | NPC19907 |
0.6207 | Remote Similarity | NPC324812 |
0.6207 | Remote Similarity | NPC178644 |
0.6197 | Remote Similarity | NPC40574 |
0.6197 | Remote Similarity | NPC2634 |
0.6197 | Remote Similarity | NPC251929 |
0.6197 | Remote Similarity | NPC265782 |
0.6197 | Remote Similarity | NPC151045 |
0.6197 | Remote Similarity | NPC246722 |
0.6197 | Remote Similarity | NPC260040 |
0.619 | Remote Similarity | NPC473733 |
0.6176 | Remote Similarity | NPC474304 |
0.6176 | Remote Similarity | NPC251118 |
0.6176 | Remote Similarity | NPC19569 |
0.6176 | Remote Similarity | NPC474329 |
0.6164 | Remote Similarity | NPC309852 |
0.6164 | Remote Similarity | NPC159497 |
0.6154 | Remote Similarity | NPC185839 |
0.6154 | Remote Similarity | NPC472304 |
0.6154 | Remote Similarity | NPC276764 |
0.614 | Remote Similarity | NPC24824 |
0.614 | Remote Similarity | NPC210560 |
0.614 | Remote Similarity | NPC165651 |
0.6133 | Remote Similarity | NPC86917 |
0.6133 | Remote Similarity | NPC276769 |
0.6129 | Remote Similarity | NPC5626 |
0.6119 | Remote Similarity | NPC211291 |
0.6119 | Remote Similarity | NPC288253 |
0.6119 | Remote Similarity | NPC124112 |
0.6119 | Remote Similarity | NPC133368 |
0.6111 | Remote Similarity | NPC48930 |
0.6111 | Remote Similarity | NPC5701 |
0.6111 | Remote Similarity | NPC54123 |
0.6111 | Remote Similarity | NPC181204 |
0.6111 | Remote Similarity | NPC234707 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC95581 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 |
---|---|---|---|
0.6508 | Remote Similarity | NPD287 | Approved |
0.6429 | Remote Similarity | NPD4747 | Approved |
0.6377 | Remote Similarity | NPD3621 | Clinical (unspecified phase) |
0.6338 | Remote Similarity | NPD5276 | Approved |
0.6286 | Remote Similarity | NPD4137 | Phase 3 |
0.6197 | Remote Similarity | NPD4691 | Approved |
0.6164 | Remote Similarity | NPD4687 | Approved |
0.6164 | Remote Similarity | NPD5733 | Approved |
0.6053 | Remote Similarity | NPD5784 | Clinical (unspecified phase) |
0.5946 | Remote Similarity | NPD4058 | Approved |
0.5926 | Remote Similarity | NPD5783 | Phase 3 |
0.5802 | Remote Similarity | NPD4786 | Approved |
0.575 | Remote Similarity | NPD3667 | Approved |
0.5679 | Remote Similarity | NPD5362 | Discontinued |
0.5663 | Remote Similarity | NPD5279 | Phase 3 |
0.5625 | Remote Similarity | NPD857 | Phase 3 |
0.5616 | Remote Similarity | NPD6922 | Approved |
0.5616 | Remote Similarity | NPD6923 | Approved |
0.561 | Remote Similarity | NPD3665 | Phase 1 |
0.561 | Remote Similarity | NPD3668 | Phase 3 |
0.561 | Remote Similarity | NPD3133 | Approved |
0.561 | Remote Similarity | NPD3666 | Approved |
PubChem CID   | 1252759 |
ChEMBL   | CHEMBL3184714 |
ZINC   |
Molecular Weight:   | 152.12 |
ALogP:   | 1.4271 |
MLogP:   | 2.45 |
XLogP:   | 2.924 |
# Rotatable Bonds:   | 5 |
Polar Surface Area:   | 17.07 |
# H-Bond Aceptor:   | 1 |
# H-Bond Donor:   | 0 |
# Rings:   | 1 |
# Heavy Atoms:   | 11 |