Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT168 | Cell Line | P388 | Mus musculus | ED50 | = | 1.5 | ug/ml | 22647719 |
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 NPC40082 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 |
---|---|---|
0.9825 | High Similarity | NPC251042 |
0.9825 | High Similarity | NPC122521 |
0.9825 | High Similarity | NPC174447 |
0.931 | High Similarity | NPC106851 |
0.931 | High Similarity | NPC274927 |
0.9153 | High Similarity | NPC235242 |
0.9123 | High Similarity | NPC325977 |
0.8906 | High Similarity | NPC143396 |
0.8793 | High Similarity | NPC18951 |
0.8793 | High Similarity | NPC477201 |
0.8772 | High Similarity | NPC322461 |
0.8667 | High Similarity | NPC329550 |
0.8644 | High Similarity | NPC225929 |
0.8596 | High Similarity | NPC139029 |
0.8596 | High Similarity | NPC36061 |
0.8596 | High Similarity | NPC1813 |
0.8596 | High Similarity | NPC294548 |
0.85 | High Similarity | NPC34416 |
0.8448 | Intermediate Similarity | NPC154245 |
0.8448 | Intermediate Similarity | NPC88966 |
0.8448 | Intermediate Similarity | NPC32467 |
0.8448 | Intermediate Similarity | NPC281972 |
0.8448 | Intermediate Similarity | NPC261831 |
0.8448 | Intermediate Similarity | NPC87564 |
0.8448 | Intermediate Similarity | NPC424 |
0.8448 | Intermediate Similarity | NPC6095 |
0.8448 | Intermediate Similarity | NPC25417 |
0.8448 | Intermediate Similarity | NPC85813 |
0.8448 | Intermediate Similarity | NPC290563 |
0.8421 | Intermediate Similarity | NPC281245 |
0.8382 | Intermediate Similarity | NPC474321 |
0.8281 | Intermediate Similarity | NPC318420 |
0.8281 | Intermediate Similarity | NPC326268 |
0.8276 | Intermediate Similarity | NPC70387 |
0.8276 | Intermediate Similarity | NPC321062 |
0.8226 | Intermediate Similarity | NPC229252 |
0.8226 | Intermediate Similarity | NPC143857 |
0.8182 | Intermediate Similarity | NPC476614 |
0.8167 | Intermediate Similarity | NPC187777 |
0.8167 | Intermediate Similarity | NPC179764 |
0.8116 | Intermediate Similarity | NPC227396 |
0.8103 | Intermediate Similarity | NPC92114 |
0.8088 | Intermediate Similarity | NPC288667 |
0.807 | Intermediate Similarity | NPC224227 |
0.8 | Intermediate Similarity | NPC136164 |
0.8 | Intermediate Similarity | NPC245947 |
0.8 | Intermediate Similarity | NPC228473 |
0.8 | Intermediate Similarity | NPC473863 |
0.8 | Intermediate Similarity | NPC255863 |
0.8 | Intermediate Similarity | NPC274290 |
0.8 | Intermediate Similarity | NPC54766 |
0.7937 | Intermediate Similarity | NPC243532 |
0.7931 | Intermediate Similarity | NPC262968 |
0.7895 | Intermediate Similarity | NPC5413 |
0.7895 | Intermediate Similarity | NPC149821 |
0.7879 | Intermediate Similarity | NPC142423 |
0.7879 | Intermediate Similarity | NPC308294 |
0.7812 | Intermediate Similarity | NPC201939 |
0.7794 | Intermediate Similarity | NPC236208 |
0.7759 | Intermediate Similarity | NPC59051 |
0.7719 | Intermediate Similarity | NPC207292 |
0.7719 | Intermediate Similarity | NPC180534 |
0.7692 | Intermediate Similarity | NPC53109 |
0.7692 | Intermediate Similarity | NPC322457 |
0.7692 | Intermediate Similarity | NPC477830 |
0.7692 | Intermediate Similarity | NPC477707 |
0.7692 | Intermediate Similarity | NPC143168 |
0.7681 | Intermediate Similarity | NPC476660 |
0.7667 | Intermediate Similarity | NPC39633 |
0.7667 | Intermediate Similarity | NPC139545 |
0.7667 | Intermediate Similarity | NPC309606 |
0.7656 | Intermediate Similarity | NPC328311 |
0.7627 | Intermediate Similarity | NPC477458 |
0.7576 | Intermediate Similarity | NPC328089 |
0.7576 | Intermediate Similarity | NPC470320 |
0.7576 | Intermediate Similarity | NPC68343 |
0.7576 | Intermediate Similarity | NPC7029 |
0.7538 | Intermediate Similarity | NPC321838 |
0.7536 | Intermediate Similarity | NPC262673 |
0.7536 | Intermediate Similarity | NPC473772 |
0.7536 | Intermediate Similarity | NPC67608 |
0.75 | Intermediate Similarity | NPC18357 |
0.75 | Intermediate Similarity | NPC148192 |
0.75 | Intermediate Similarity | NPC330426 |
0.75 | Intermediate Similarity | NPC99619 |
0.75 | Intermediate Similarity | NPC260396 |
0.75 | Intermediate Similarity | NPC22101 |
0.75 | Intermediate Similarity | NPC127091 |
0.75 | Intermediate Similarity | NPC104537 |
0.75 | Intermediate Similarity | NPC26500 |
0.75 | Intermediate Similarity | NPC271921 |
0.746 | Intermediate Similarity | NPC281230 |
0.746 | Intermediate Similarity | NPC192843 |
0.7432 | Intermediate Similarity | NPC192006 |
0.7429 | Intermediate Similarity | NPC42526 |
0.7429 | Intermediate Similarity | NPC291062 |
0.7429 | Intermediate Similarity | NPC94743 |
0.7429 | Intermediate Similarity | NPC318766 |
0.7419 | Intermediate Similarity | NPC52264 |
0.7419 | Intermediate Similarity | NPC128061 |
0.7419 | Intermediate Similarity | NPC223677 |
0.7419 | Intermediate Similarity | NPC28779 |
0.7419 | Intermediate Similarity | NPC10316 |
0.7419 | Intermediate Similarity | NPC200845 |
0.7414 | Intermediate Similarity | NPC91495 |
0.7391 | Intermediate Similarity | NPC324981 |
0.7391 | Intermediate Similarity | NPC48218 |
0.7391 | Intermediate Similarity | NPC473559 |
0.7391 | Intermediate Similarity | NPC141481 |
0.7385 | Intermediate Similarity | NPC327112 |
0.7377 | Intermediate Similarity | NPC71761 |
0.7368 | Intermediate Similarity | NPC117572 |
0.7344 | Intermediate Similarity | NPC267817 |
0.7333 | Intermediate Similarity | NPC470412 |
0.7333 | Intermediate Similarity | NPC28205 |
0.7333 | Intermediate Similarity | NPC470410 |
0.7333 | Intermediate Similarity | NPC284212 |
0.7313 | Intermediate Similarity | NPC226592 |
0.7273 | Intermediate Similarity | NPC174560 |
0.7273 | Intermediate Similarity | NPC320305 |
0.7273 | Intermediate Similarity | NPC125312 |
0.7273 | Intermediate Similarity | NPC328776 |
0.7258 | Intermediate Similarity | NPC137538 |
0.7258 | Intermediate Similarity | NPC87394 |
0.7246 | Intermediate Similarity | NPC60120 |
0.7246 | Intermediate Similarity | NPC475443 |
0.7246 | Intermediate Similarity | NPC243272 |
0.7246 | Intermediate Similarity | NPC473829 |
0.7231 | Intermediate Similarity | NPC329249 |
0.7222 | Intermediate Similarity | NPC326024 |
0.7222 | Intermediate Similarity | NPC325627 |
0.7206 | Intermediate Similarity | NPC296436 |
0.7206 | Intermediate Similarity | NPC176215 |
0.7206 | Intermediate Similarity | NPC320642 |
0.7206 | Intermediate Similarity | NPC476655 |
0.7206 | Intermediate Similarity | NPC476657 |
0.7206 | Intermediate Similarity | NPC476654 |
0.72 | Intermediate Similarity | NPC74410 |
0.72 | Intermediate Similarity | NPC182292 |
0.7183 | Intermediate Similarity | NPC67183 |
0.7167 | Intermediate Similarity | NPC474391 |
0.7164 | Intermediate Similarity | NPC54925 |
0.7162 | Intermediate Similarity | NPC180886 |
0.7143 | Intermediate Similarity | NPC218477 |
0.7143 | Intermediate Similarity | NPC125578 |
0.7143 | Intermediate Similarity | NPC263382 |
0.7143 | Intermediate Similarity | NPC146376 |
0.7143 | Intermediate Similarity | NPC134385 |
0.7143 | Intermediate Similarity | NPC53302 |
0.7123 | Intermediate Similarity | NPC264178 |
0.7119 | Intermediate Similarity | NPC216130 |
0.7105 | Intermediate Similarity | NPC113363 |
0.7105 | Intermediate Similarity | NPC164308 |
0.7101 | Intermediate Similarity | NPC476656 |
0.7101 | Intermediate Similarity | NPC476659 |
0.7101 | Intermediate Similarity | NPC197089 |
0.7101 | Intermediate Similarity | NPC83965 |
0.7083 | Intermediate Similarity | NPC29328 |
0.7083 | Intermediate Similarity | NPC67076 |
0.7083 | Intermediate Similarity | NPC319163 |
0.7083 | Intermediate Similarity | NPC320119 |
0.7077 | Intermediate Similarity | NPC320421 |
0.7067 | Intermediate Similarity | NPC316324 |
0.7067 | Intermediate Similarity | NPC120776 |
0.7067 | Intermediate Similarity | NPC240170 |
0.7059 | Intermediate Similarity | NPC234767 |
0.7049 | Intermediate Similarity | NPC48162 |
0.7042 | Intermediate Similarity | NPC469914 |
0.7042 | Intermediate Similarity | NPC94488 |
0.7042 | Intermediate Similarity | NPC317583 |
0.7031 | Intermediate Similarity | NPC472808 |
0.7031 | Intermediate Similarity | NPC324224 |
0.7015 | Intermediate Similarity | NPC477829 |
0.7 | Intermediate Similarity | NPC474619 |
0.7 | Intermediate Similarity | NPC278895 |
0.7 | Intermediate Similarity | NPC49863 |
0.6986 | Remote Similarity | NPC238948 |
0.6986 | Remote Similarity | NPC329914 |
0.6986 | Remote Similarity | NPC215745 |
0.6986 | Remote Similarity | NPC12815 |
0.6986 | Remote Similarity | NPC329890 |
0.6986 | Remote Similarity | NPC474705 |
0.6984 | Remote Similarity | NPC300121 |
0.6974 | Remote Similarity | NPC169095 |
0.6962 | Remote Similarity | NPC102197 |
0.6957 | Remote Similarity | NPC323477 |
0.6957 | Remote Similarity | NPC323045 |
0.6957 | Remote Similarity | NPC317881 |
0.6935 | Remote Similarity | NPC161366 |
0.6933 | Remote Similarity | NPC266119 |
0.6933 | Remote Similarity | NPC472967 |
0.6933 | Remote Similarity | NPC279537 |
0.6933 | Remote Similarity | NPC266159 |
0.6923 | Remote Similarity | NPC278459 |
0.6923 | Remote Similarity | NPC283502 |
0.6923 | Remote Similarity | NPC90055 |
0.6923 | Remote Similarity | NPC323436 |
0.6914 | Remote Similarity | NPC234038 |
0.6892 | Remote Similarity | NPC237591 |
0.6892 | Remote Similarity | NPC92558 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC40082 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 |
---|---|---|---|
0.8596 | High Similarity | NPD3172 | Approved |
0.8448 | Intermediate Similarity | NPD3196 | Approved |
0.8448 | Intermediate Similarity | NPD3194 | Approved |
0.8448 | Intermediate Similarity | NPD4266 | Approved |
0.8448 | Intermediate Similarity | NPD3195 | Phase 2 |
0.7931 | Intermediate Similarity | NPD29 | Approved |
0.7931 | Intermediate Similarity | NPD28 | Approved |
0.7895 | Intermediate Similarity | NPD3173 | Approved |
0.7778 | Intermediate Similarity | NPD4756 | Discovery |
0.7719 | Intermediate Similarity | NPD622 | Approved |
0.7692 | Intermediate Similarity | NPD2664 | Clinical (unspecified phase) |
0.7576 | Intermediate Similarity | NPD3197 | Phase 1 |
0.7385 | Intermediate Similarity | NPD4246 | Clinical (unspecified phase) |
0.7368 | Intermediate Similarity | NPD3174 | Discontinued |
0.7368 | Intermediate Similarity | NPD4222 | Approved |
0.7101 | Intermediate Similarity | NPD7331 | Phase 2 |
0.7069 | Intermediate Similarity | NPD39 | Approved |
0.7 | Intermediate Similarity | NPD4247 | Clinical (unspecified phase) |
0.6857 | Remote Similarity | NPD6108 | Clinical (unspecified phase) |
0.679 | Remote Similarity | NPD5363 | Approved |
0.6724 | Remote Similarity | NPD5326 | Phase 3 |
0.662 | Remote Similarity | NPD3704 | Approved |
0.6582 | Remote Similarity | NPD5368 | Approved |
0.6538 | Remote Similarity | NPD5784 | Clinical (unspecified phase) |
0.6512 | Remote Similarity | NPD5281 | Approved |
0.6512 | Remote Similarity | NPD5284 | Approved |
0.65 | Remote Similarity | NPD5369 | Approved |
0.6479 | Remote Similarity | NPD7341 | Phase 2 |
0.6452 | Remote Similarity | NPD4220 | Pre-registration |
0.642 | Remote Similarity | NPD4270 | Approved |
0.642 | Remote Similarity | NPD4269 | Approved |
0.642 | Remote Similarity | NPD6435 | Approved |
0.6395 | Remote Similarity | NPD5785 | Approved |
0.6379 | Remote Similarity | NPD2270 | Approved |
0.6375 | Remote Similarity | NPD4252 | Approved |
0.6375 | Remote Similarity | NPD4695 | Discontinued |
0.6364 | Remote Similarity | NPD5122 | Clinical (unspecified phase) |
0.6316 | Remote Similarity | NPD633 | Phase 3 |
0.6316 | Remote Similarity | NPD9655 | Approved |
0.6316 | Remote Similarity | NPD9448 | Phase 2 |
0.629 | Remote Similarity | NPD5343 | Approved |
0.6279 | Remote Similarity | NPD7285 | Clinical (unspecified phase) |
0.622 | Remote Similarity | NPD5209 | Approved |
0.6173 | Remote Similarity | NPD8259 | Clinical (unspecified phase) |
0.6154 | Remote Similarity | NPD8039 | Approved |
0.6145 | Remote Similarity | NPD7154 | Phase 3 |
0.6145 | Remote Similarity | NPD5362 | Discontinued |
0.6125 | Remote Similarity | NPD3732 | Approved |
0.6125 | Remote Similarity | NPD4271 | Approved |
0.6125 | Remote Similarity | NPD4268 | Approved |
0.6119 | Remote Similarity | NPD4627 | Clinical (unspecified phase) |
0.6118 | Remote Similarity | NPD5786 | Approved |
0.6092 | Remote Similarity | NPD6101 | Approved |
0.6092 | Remote Similarity | NPD5764 | Clinical (unspecified phase) |
0.6087 | Remote Similarity | NPD6109 | Phase 1 |
0.6066 | Remote Similarity | NPD3199 | Clinical (unspecified phase) |
0.6056 | Remote Similarity | NPD4194 | Approved |
0.6056 | Remote Similarity | NPD4193 | Approved |
0.6056 | Remote Similarity | NPD4192 | Approved |
0.6056 | Remote Similarity | NPD4191 | Approved |
0.6022 | Remote Similarity | NPD2066 | Phase 3 |
0.5977 | Remote Similarity | NPD4518 | Approved |
0.5976 | Remote Similarity | NPD4821 | Approved |
0.5976 | Remote Similarity | NPD4822 | Approved |
0.5976 | Remote Similarity | NPD4819 | Approved |
0.5976 | Remote Similarity | NPD4820 | Approved |
0.5976 | Remote Similarity | NPD5790 | Clinical (unspecified phase) |
0.5955 | Remote Similarity | NPD7515 | Phase 2 |
0.5955 | Remote Similarity | NPD5694 | Approved |
0.5955 | Remote Similarity | NPD7983 | Approved |
0.5955 | Remote Similarity | NPD6411 | Approved |
0.5934 | Remote Similarity | NPD1698 | Clinical (unspecified phase) |
0.593 | Remote Similarity | NPD5280 | Approved |
0.593 | Remote Similarity | NPD5690 | Phase 2 |
0.593 | Remote Similarity | NPD4694 | Approved |
0.593 | Remote Similarity | NPD5279 | Phase 3 |
0.5889 | Remote Similarity | NPD5779 | Approved |
0.5889 | Remote Similarity | NPD5778 | Approved |
0.5862 | Remote Similarity | NPD3206 | Approved |
0.5862 | Remote Similarity | NPD3573 | Approved |
0.5843 | Remote Similarity | NPD6698 | Approved |
0.5843 | Remote Similarity | NPD5207 | Approved |
0.5843 | Remote Similarity | NPD5692 | Phase 3 |
0.5843 | Remote Similarity | NPD7838 | Discovery |
0.5843 | Remote Similarity | NPD46 | Approved |
0.5833 | Remote Similarity | NPD4221 | Approved |
0.5833 | Remote Similarity | NPD4752 | Clinical (unspecified phase) |
0.5833 | Remote Similarity | NPD4223 | Phase 3 |
0.5824 | Remote Similarity | NPD7748 | Approved |
0.5823 | Remote Similarity | NPD4058 | Approved |
0.5806 | Remote Similarity | NPD6097 | Approved |
0.5806 | Remote Similarity | NPD6096 | Approved |
0.5778 | Remote Similarity | NPD6050 | Approved |
0.5765 | Remote Similarity | NPD5332 | Approved |
0.5765 | Remote Similarity | NPD5331 | Approved |
0.5761 | Remote Similarity | NPD5695 | Phase 3 |
0.5747 | Remote Similarity | NPD4519 | Discontinued |
0.5747 | Remote Similarity | NPD4623 | Approved |
0.5747 | Remote Similarity | NPD3574 | Clinical (unspecified phase) |
0.5735 | Remote Similarity | NPD3729 | Clinical (unspecified phase) |
0.5735 | Remote Similarity | NPD3728 | Approved |
0.5735 | Remote Similarity | NPD3730 | Approved |
0.573 | Remote Similarity | NPD5346 | Phase 2 |
0.573 | Remote Similarity | NPD5347 | Phase 2 |
0.573 | Remote Similarity | NPD5370 | Suspended |
0.5714 | Remote Similarity | NPD226 | Approved |
0.5714 | Remote Similarity | NPD4790 | Discontinued |
0.5714 | Remote Similarity | NPD634 | Phase 3 |
0.5699 | Remote Similarity | NPD7614 | Phase 1 |
0.5699 | Remote Similarity | NPD7839 | Suspended |
0.5698 | Remote Similarity | NPD3665 | Phase 1 |
0.5698 | Remote Similarity | NPD3666 | Approved |
0.5698 | Remote Similarity | NPD4197 | Approved |
0.5698 | Remote Similarity | NPD3133 | Approved |
0.5682 | Remote Similarity | NPD4793 | Discontinued |
0.567 | Remote Similarity | NPD1930 | Approved |
0.567 | Remote Similarity | NPD6647 | Phase 2 |
0.567 | Remote Similarity | NPD1929 | Approved |
0.567 | Remote Similarity | NPD1931 | Clinical (unspecified phase) |
0.5667 | Remote Similarity | NPD4096 | Approved |
0.5658 | Remote Similarity | NPD3709 | Clinical (unspecified phase) |
0.5645 | Remote Similarity | NPD9411 | Phase 1 |
0.5638 | Remote Similarity | NPD6083 | Phase 2 |
0.5638 | Remote Similarity | NPD7902 | Approved |
0.5638 | Remote Similarity | NPD6084 | Phase 2 |
0.5632 | Remote Similarity | NPD1694 | Approved |
0.5632 | Remote Similarity | NPD5329 | Approved |
0.5625 | Remote Similarity | NPD4687 | Approved |
0.5618 | Remote Similarity | NPD6672 | Approved |
0.5618 | Remote Similarity | NPD5737 | Approved |
0.5604 | Remote Similarity | NPD4810 | Clinical (unspecified phase) |
0.5604 | Remote Similarity | NPD6079 | Approved |
0.56 | Remote Similarity | NPD2685 | Clinical (unspecified phase) |
PubChem CID   | 6440816 |
ChEMBL   | CHEMBL478594 |
ZINC   |
Molecular Weight:   | 308.20 |
ALogP:   | -1.9055 |
MLogP:   | 3 |
XLogP:   | 3.564 |
# Rotatable Bonds:   | 16 |
Polar Surface Area:   | 71.44 |
# H-Bond Aceptor:   | 4 |
# H-Bond Donor:   | 1 |
# Rings:   | 0 |
# Heavy Atoms:   | 22 |