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 NPC246722 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 | NPC151045 |
0.8382 | Intermediate Similarity | NPC470329 |
0.8235 | Intermediate Similarity | NPC285371 |
0.8235 | Intermediate Similarity | NPC6697 |
0.8228 | Intermediate Similarity | NPC15838 |
0.8228 | Intermediate Similarity | NPC132629 |
0.8209 | Intermediate Similarity | NPC213152 |
0.8194 | Intermediate Similarity | NPC5701 |
0.8169 | Intermediate Similarity | NPC256846 |
0.8143 | Intermediate Similarity | NPC475523 |
0.8056 | Intermediate Similarity | NPC307176 |
0.8 | Intermediate Similarity | NPC69408 |
0.7973 | Intermediate Similarity | NPC255021 |
0.7971 | Intermediate Similarity | NPC473902 |
0.7971 | Intermediate Similarity | NPC212210 |
0.7945 | Intermediate Similarity | NPC223187 |
0.7941 | Intermediate Similarity | NPC475795 |
0.7941 | Intermediate Similarity | NPC97322 |
0.7917 | Intermediate Similarity | NPC139397 |
0.7879 | Intermediate Similarity | NPC192427 |
0.7857 | Intermediate Similarity | NPC251118 |
0.7838 | Intermediate Similarity | NPC303613 |
0.7838 | Intermediate Similarity | NPC474228 |
0.7826 | Intermediate Similarity | NPC165695 |
0.7826 | Intermediate Similarity | NPC472306 |
0.7826 | Intermediate Similarity | NPC32285 |
0.7808 | Intermediate Similarity | NPC260040 |
0.7808 | Intermediate Similarity | NPC35734 |
0.7808 | Intermediate Similarity | NPC265782 |
0.7808 | Intermediate Similarity | NPC2634 |
0.7808 | Intermediate Similarity | NPC251929 |
0.7808 | Intermediate Similarity | NPC159577 |
0.7808 | Intermediate Similarity | NPC282593 |
0.7794 | Intermediate Similarity | NPC127582 |
0.7778 | Intermediate Similarity | NPC87141 |
0.7778 | Intermediate Similarity | NPC260474 |
0.7778 | Intermediate Similarity | NPC188292 |
0.7761 | Intermediate Similarity | NPC27610 |
0.7761 | Intermediate Similarity | NPC56905 |
0.7727 | Intermediate Similarity | NPC20603 |
0.7714 | Intermediate Similarity | NPC475124 |
0.7703 | Intermediate Similarity | NPC54123 |
0.7703 | Intermediate Similarity | NPC115023 |
0.7703 | Intermediate Similarity | NPC474562 |
0.7703 | Intermediate Similarity | NPC304983 |
0.7692 | Intermediate Similarity | NPC90965 |
0.7681 | Intermediate Similarity | NPC60565 |
0.7647 | Intermediate Similarity | NPC259261 |
0.7647 | Intermediate Similarity | NPC472304 |
0.7647 | Intermediate Similarity | NPC276764 |
0.7632 | Intermediate Similarity | NPC255650 |
0.7632 | Intermediate Similarity | NPC473171 |
0.7612 | Intermediate Similarity | NPC193695 |
0.76 | Intermediate Similarity | NPC470044 |
0.76 | Intermediate Similarity | NPC470045 |
0.76 | Intermediate Similarity | NPC251705 |
0.7571 | Intermediate Similarity | NPC288253 |
0.7568 | Intermediate Similarity | NPC214770 |
0.7568 | Intermediate Similarity | NPC477856 |
0.7538 | Intermediate Similarity | NPC474141 |
0.7536 | Intermediate Similarity | NPC25853 |
0.7534 | Intermediate Similarity | NPC155198 |
0.7534 | Intermediate Similarity | NPC310992 |
0.7534 | Intermediate Similarity | NPC20610 |
0.75 | Intermediate Similarity | NPC170799 |
0.75 | Intermediate Similarity | NPC311852 |
0.75 | Intermediate Similarity | NPC266295 |
0.75 | Intermediate Similarity | NPC30215 |
0.75 | Intermediate Similarity | NPC308108 |
0.75 | Intermediate Similarity | NPC94991 |
0.75 | Intermediate Similarity | NPC309852 |
0.7467 | Intermediate Similarity | NPC305501 |
0.7467 | Intermediate Similarity | NPC190035 |
0.7467 | Intermediate Similarity | NPC234707 |
0.7465 | Intermediate Similarity | NPC469662 |
0.7432 | Intermediate Similarity | NPC61702 |
0.7432 | Intermediate Similarity | NPC182815 |
0.7432 | Intermediate Similarity | NPC477857 |
0.7432 | Intermediate Similarity | NPC162867 |
0.7403 | Intermediate Similarity | NPC293803 |
0.7368 | Intermediate Similarity | NPC56747 |
0.7368 | Intermediate Similarity | NPC474488 |
0.7368 | Intermediate Similarity | NPC109576 |
0.7368 | Intermediate Similarity | NPC130016 |
0.7368 | Intermediate Similarity | NPC180015 |
0.7353 | Intermediate Similarity | NPC115385 |
0.7353 | Intermediate Similarity | NPC267626 |
0.7353 | Intermediate Similarity | NPC49575 |
0.7353 | Intermediate Similarity | NPC55004 |
0.7342 | Intermediate Similarity | NPC469996 |
0.7342 | Intermediate Similarity | NPC115515 |
0.7324 | Intermediate Similarity | NPC202118 |
0.7324 | Intermediate Similarity | NPC167256 |
0.7324 | Intermediate Similarity | NPC197238 |
0.7317 | Intermediate Similarity | NPC41539 |
0.7273 | Intermediate Similarity | NPC268564 |
0.7273 | Intermediate Similarity | NPC474797 |
0.7273 | Intermediate Similarity | NPC474796 |
0.7273 | Intermediate Similarity | NPC329866 |
0.726 | Intermediate Similarity | NPC189917 |
0.726 | Intermediate Similarity | NPC107704 |
0.726 | Intermediate Similarity | NPC96812 |
0.726 | Intermediate Similarity | NPC323005 |
0.726 | Intermediate Similarity | NPC39462 |
0.726 | Intermediate Similarity | NPC168824 |
0.725 | Intermediate Similarity | NPC170793 |
0.7237 | Intermediate Similarity | NPC181204 |
0.7237 | Intermediate Similarity | NPC470078 |
0.7229 | Intermediate Similarity | NPC320801 |
0.72 | Intermediate Similarity | NPC286814 |
0.7195 | Intermediate Similarity | NPC472867 |
0.7179 | Intermediate Similarity | NPC65650 |
0.7179 | Intermediate Similarity | NPC476346 |
0.7162 | Intermediate Similarity | NPC4370 |
0.7162 | Intermediate Similarity | NPC290350 |
0.716 | Intermediate Similarity | NPC474509 |
0.7143 | Intermediate Similarity | NPC143834 |
0.7143 | Intermediate Similarity | NPC11711 |
0.7143 | Intermediate Similarity | NPC8571 |
0.7143 | Intermediate Similarity | NPC94531 |
0.7143 | Intermediate Similarity | NPC142649 |
0.7143 | Intermediate Similarity | NPC311702 |
0.7143 | Intermediate Similarity | NPC472940 |
0.7143 | Intermediate Similarity | NPC472931 |
0.7143 | Intermediate Similarity | NPC123319 |
0.7125 | Intermediate Similarity | NPC228911 |
0.7105 | Intermediate Similarity | NPC40574 |
0.7101 | Intermediate Similarity | NPC230823 |
0.7093 | Intermediate Similarity | NPC474854 |
0.7089 | Intermediate Similarity | NPC469796 |
0.7089 | Intermediate Similarity | NPC469793 |
0.7089 | Intermediate Similarity | NPC180886 |
0.7089 | Intermediate Similarity | NPC1254 |
0.7077 | Intermediate Similarity | NPC116906 |
0.7073 | Intermediate Similarity | NPC477372 |
0.7073 | Intermediate Similarity | NPC136150 |
0.7073 | Intermediate Similarity | NPC189237 |
0.7067 | Intermediate Similarity | NPC296697 |
0.7067 | Intermediate Similarity | NPC142754 |
0.7067 | Intermediate Similarity | NPC39157 |
0.7067 | Intermediate Similarity | NPC82477 |
0.7059 | Intermediate Similarity | NPC6247 |
0.7059 | Intermediate Similarity | NPC200258 |
0.7042 | Intermediate Similarity | NPC270042 |
0.7037 | Intermediate Similarity | NPC472490 |
0.7027 | Intermediate Similarity | NPC92327 |
0.7027 | Intermediate Similarity | NPC176171 |
0.7024 | Intermediate Similarity | NPC181743 |
0.7024 | Intermediate Similarity | NPC16287 |
0.7024 | Intermediate Similarity | NPC178025 |
0.7015 | Intermediate Similarity | NPC296311 |
0.7015 | Intermediate Similarity | NPC23117 |
0.7013 | Intermediate Similarity | NPC133253 |
0.7013 | Intermediate Similarity | NPC225467 |
0.7 | Intermediate Similarity | NPC472300 |
0.6988 | Remote Similarity | NPC477271 |
0.6988 | Remote Similarity | NPC320514 |
0.6988 | Remote Similarity | NPC142253 |
0.6988 | Remote Similarity | NPC193347 |
0.6988 | Remote Similarity | NPC321289 |
0.6988 | Remote Similarity | NPC472239 |
0.6988 | Remote Similarity | NPC477269 |
0.6988 | Remote Similarity | NPC129080 |
0.6988 | Remote Similarity | NPC477270 |
0.6988 | Remote Similarity | NPC3511 |
0.6988 | Remote Similarity | NPC327969 |
0.6986 | Remote Similarity | NPC4638 |
0.697 | Remote Similarity | NPC236623 |
0.697 | Remote Similarity | NPC64866 |
0.6962 | Remote Similarity | NPC469678 |
0.6962 | Remote Similarity | NPC469669 |
0.6962 | Remote Similarity | NPC475771 |
0.6957 | Remote Similarity | NPC473733 |
0.6951 | Remote Similarity | NPC26139 |
0.6951 | Remote Similarity | NPC472478 |
0.6941 | Remote Similarity | NPC179006 |
0.6941 | Remote Similarity | NPC60350 |
0.6941 | Remote Similarity | NPC474853 |
0.6933 | Remote Similarity | NPC220210 |
0.6933 | Remote Similarity | NPC20181 |
0.6933 | Remote Similarity | NPC176107 |
0.6923 | Remote Similarity | NPC52667 |
0.6914 | Remote Similarity | NPC23778 |
0.6914 | Remote Similarity | NPC189485 |
0.6914 | Remote Similarity | NPC275494 |
0.6914 | Remote Similarity | NPC470052 |
0.6914 | Remote Similarity | NPC82635 |
0.6914 | Remote Similarity | NPC471409 |
0.6914 | Remote Similarity | NPC74410 |
0.6912 | Remote Similarity | NPC5626 |
0.6905 | Remote Similarity | NPC469561 |
0.6905 | Remote Similarity | NPC470015 |
0.6905 | Remote Similarity | NPC271784 |
0.6905 | Remote Similarity | NPC470165 |
0.6905 | Remote Similarity | NPC168188 |
0.6901 | Remote Similarity | NPC285594 |
0.6901 | Remote Similarity | NPC96551 |
0.6875 | Remote Similarity | NPC473223 |
0.6842 | Remote Similarity | NPC469679 |
0.6835 | Remote Similarity | NPC219232 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC246722 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 |
---|---|---|---|
0.8056 | Intermediate Similarity | NPD4747 | Approved |
0.7917 | Intermediate Similarity | NPD4137 | Phase 3 |
0.7808 | Intermediate Similarity | NPD4691 | Approved |
0.7733 | Intermediate Similarity | NPD5733 | Approved |
0.7733 | Intermediate Similarity | NPD4687 | Approved |
0.7703 | Intermediate Similarity | NPD5276 | Approved |
0.75 | Intermediate Similarity | NPD287 | Approved |
0.75 | Intermediate Similarity | NPD4058 | Approved |
0.7297 | Intermediate Similarity | NPD3621 | Clinical (unspecified phase) |
0.6988 | Remote Similarity | NPD4221 | Approved |
0.6988 | Remote Similarity | NPD4223 | Phase 3 |
0.6824 | Remote Similarity | NPD4197 | Approved |
0.6744 | Remote Similarity | NPD5329 | Approved |
0.6707 | Remote Similarity | NPD3617 | Approved |
0.6706 | Remote Similarity | NPD3527 | Clinical (unspecified phase) |
0.6667 | Remote Similarity | NPD4690 | Approved |
0.6667 | Remote Similarity | NPD4623 | Approved |
0.6667 | Remote Similarity | NPD5690 | Phase 2 |
0.6667 | Remote Similarity | NPD5280 | Approved |
0.6667 | Remote Similarity | NPD4688 | Approved |
0.6667 | Remote Similarity | NPD4138 | Approved |
0.6667 | Remote Similarity | NPD4694 | Approved |
0.6667 | Remote Similarity | NPD4519 | Discontinued |
0.6667 | Remote Similarity | NPD5205 | Approved |
0.6667 | Remote Similarity | NPD4689 | Approved |
0.6667 | Remote Similarity | NPD4693 | Phase 3 |
0.6628 | Remote Similarity | NPD3665 | Phase 1 |
0.6628 | Remote Similarity | NPD3666 | Approved |
0.6628 | Remote Similarity | NPD3133 | Approved |
0.6548 | Remote Similarity | NPD4695 | Discontinued |
0.6522 | Remote Similarity | NPD6001 | Approved |
0.6517 | Remote Similarity | NPD6672 | Approved |
0.6517 | Remote Similarity | NPD5208 | Approved |
0.6517 | Remote Similarity | NPD5737 | Approved |
0.6477 | Remote Similarity | NPD7146 | Approved |
0.6477 | Remote Similarity | NPD5279 | Phase 3 |
0.6477 | Remote Similarity | NPD3618 | Phase 1 |
0.6477 | Remote Similarity | NPD5330 | Approved |
0.6477 | Remote Similarity | NPD6684 | Approved |
0.6477 | Remote Similarity | NPD7521 | Approved |
0.6477 | Remote Similarity | NPD7334 | Approved |
0.6477 | Remote Similarity | NPD6409 | Approved |
0.6471 | Remote Similarity | NPD8028 | Phase 2 |
0.6452 | Remote Similarity | NPD4629 | Approved |
0.6452 | Remote Similarity | NPD6356 | Clinical (unspecified phase) |
0.6452 | Remote Similarity | NPD5210 | Approved |
0.6444 | Remote Similarity | NPD6904 | Approved |
0.6444 | Remote Similarity | NPD6673 | Approved |
0.6444 | Remote Similarity | NPD6080 | Approved |
0.6444 | Remote Similarity | NPD4753 | Phase 2 |
0.6444 | Remote Similarity | NPD5328 | Approved |
0.6437 | Remote Similarity | NPD4786 | Approved |
0.6413 | Remote Similarity | NPD5133 | Approved |
0.6395 | Remote Similarity | NPD3667 | Approved |
0.6374 | Remote Similarity | NPD5692 | Phase 3 |
0.6374 | Remote Similarity | NPD5207 | Approved |
0.6364 | Remote Similarity | NPD7331 | Phase 2 |
0.6333 | Remote Similarity | NPD6903 | Approved |
0.6333 | Remote Similarity | NPD7513 | Clinical (unspecified phase) |
0.6304 | Remote Similarity | NPD6050 | Approved |
0.6304 | Remote Similarity | NPD5693 | Phase 1 |
0.6304 | Remote Similarity | NPD6079 | Approved |
0.6304 | Remote Similarity | NPD5281 | Approved |
0.6304 | Remote Similarity | NPD5694 | Approved |
0.6304 | Remote Similarity | NPD5284 | Approved |
0.6292 | Remote Similarity | NPD3574 | Clinical (unspecified phase) |
0.6292 | Remote Similarity | NPD6098 | Approved |
0.6279 | Remote Similarity | NPD4139 | Approved |
0.6279 | Remote Similarity | NPD4692 | Approved |
0.625 | Remote Similarity | NPD5696 | Approved |
0.625 | Remote Similarity | NPD3668 | Phase 3 |
0.6237 | Remote Similarity | NPD4202 | Approved |
0.6235 | Remote Similarity | NPD4195 | Approved |
0.6234 | Remote Similarity | NPD7341 | Phase 2 |
0.6222 | Remote Similarity | NPD3573 | Approved |
0.6196 | Remote Similarity | NPD4096 | Approved |
0.618 | Remote Similarity | NPD1696 | Phase 3 |
0.6154 | Remote Similarity | NPD4518 | Approved |
0.6146 | Remote Similarity | NPD5959 | Approved |
0.6105 | Remote Similarity | NPD5695 | Phase 3 |
0.6061 | Remote Similarity | NPD5091 | Approved |
0.6042 | Remote Similarity | NPD5221 | Approved |
0.6042 | Remote Similarity | NPD5220 | Clinical (unspecified phase) |
0.6042 | Remote Similarity | NPD4697 | Phase 3 |
0.6042 | Remote Similarity | NPD5222 | Approved |
0.6023 | Remote Similarity | NPD4752 | Clinical (unspecified phase) |
0.5979 | Remote Similarity | NPD4755 | Approved |
0.5979 | Remote Similarity | NPD6083 | Phase 2 |
0.5979 | Remote Similarity | NPD6084 | Phase 2 |
0.5979 | Remote Similarity | NPD5173 | Approved |
0.5957 | Remote Similarity | NPD7515 | Phase 2 |
0.5955 | Remote Similarity | NPD4788 | Approved |
0.5938 | Remote Similarity | NPD5654 | Approved |
0.5914 | Remote Similarity | NPD7285 | Clinical (unspecified phase) |
0.5895 | Remote Similarity | NPD6399 | Phase 3 |
0.589 | Remote Similarity | NPD4627 | Clinical (unspecified phase) |
0.5876 | Remote Similarity | NPD7732 | Phase 3 |
0.5876 | Remote Similarity | NPD7614 | Phase 1 |
0.5859 | Remote Similarity | NPD5285 | Approved |
0.5859 | Remote Similarity | NPD5286 | Approved |
0.5859 | Remote Similarity | NPD4696 | Approved |
0.5859 | Remote Similarity | NPD4700 | Approved |
0.5844 | Remote Similarity | NPD4194 | Approved |
0.5844 | Remote Similarity | NPD4192 | Approved |
0.5844 | Remote Similarity | NPD4191 | Approved |
0.5844 | Remote Similarity | NPD4193 | Approved |
0.5843 | Remote Similarity | NPD5209 | Approved |
0.5833 | Remote Similarity | NPD7901 | Clinical (unspecified phase) |
0.5833 | Remote Similarity | NPD7748 | Approved |
0.5833 | Remote Similarity | NPD7900 | Approved |
0.5825 | Remote Similarity | NPD6614 | Approved |
0.5824 | Remote Similarity | NPD1694 | Approved |
0.58 | Remote Similarity | NPD5223 | Approved |
0.5795 | Remote Similarity | NPD8259 | Clinical (unspecified phase) |
0.5747 | Remote Similarity | NPD5784 | Clinical (unspecified phase) |
0.5743 | Remote Similarity | NPD4633 | Approved |
0.5743 | Remote Similarity | NPD5224 | Approved |
0.5743 | Remote Similarity | NPD5226 | Approved |
0.5743 | Remote Similarity | NPD5211 | Phase 2 |
0.5743 | Remote Similarity | NPD5225 | Approved |
0.5728 | Remote Similarity | NPD6008 | Approved |
0.5686 | Remote Similarity | NPD5174 | Approved |
0.5686 | Remote Similarity | NPD6052 | Approved |
0.5686 | Remote Similarity | NPD5175 | Approved |
0.5686 | Remote Similarity | NPD4754 | Approved |
0.5657 | Remote Similarity | NPD3495 | Discontinued |
0.5657 | Remote Similarity | NPD7902 | Approved |
0.5652 | Remote Similarity | NPD344 | Approved |
0.5652 | Remote Similarity | NPD343 | Approved |
0.5652 | Remote Similarity | NPD345 | Approved |
0.5631 | Remote Similarity | NPD5141 | Approved |
PubChem CID   | 71577334 |
ChEMBL   | CHEMBL2334876 |
ZINC   |
Molecular Weight:   | 298.19 |
ALogP:   | 2.0029 |
MLogP:   | 3.44 |
XLogP:   | 3.615 |
# Rotatable Bonds:   | 4 |
Polar Surface Area:   | 34.14 |
# H-Bond Aceptor:   | 2 |
# H-Bond Donor:   | 0 |
# Rings:   | 4 |
# Heavy Atoms:   | 22 |