Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO11100 | Artemisia capillaris | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO12405 | Descurainia sophia | Species | Brassicaceae | Eukaryota | TM-MC* | |||
NPO26293 | Ginkgo biloba | Species | Ginkgoaceae | Eukaryota | TM-MC* | |||
NPO11097 | Lepidium apetalum | Species | Brassicaceae | Eukaryota | TM-MC* | |||
NPO23429 | Lycium barbarum | Species | Solanaceae | Eukaryota | TM-MC* | |||
NPO17823 | Lycium chinense | Species | Solanaceae | Eukaryota | TM-MC* | |||
NPO3477 | Plantago asiatica | Species | Plantaginaceae | Eukaryota | TM-MC* | |||
NPO8918 | Plantago depressa | Species | Plantaginaceae | Eukaryota | TM-MC* | |||
NPO7539 | Raphanus sativus | Species | Brassicaceae | Eukaryota | TM-MC* | |||
NPO26650 | Terminalia chebula | Species | Combretaceae | 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 NPC1813 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 | NPC36061 |
1.0 | High Similarity | NPC294548 |
1.0 | High Similarity | NPC139029 |
0.98 | High Similarity | NPC424 |
0.98 | High Similarity | NPC88966 |
0.98 | High Similarity | NPC87564 |
0.98 | High Similarity | NPC6095 |
0.98 | High Similarity | NPC25417 |
0.98 | High Similarity | NPC154245 |
0.98 | High Similarity | NPC290563 |
0.98 | High Similarity | NPC261831 |
0.98 | High Similarity | NPC85813 |
0.98 | High Similarity | NPC32467 |
0.98 | High Similarity | NPC281972 |
0.9796 | High Similarity | NPC281245 |
0.96 | High Similarity | NPC321062 |
0.96 | High Similarity | NPC70387 |
0.9423 | High Similarity | NPC179764 |
0.9423 | High Similarity | NPC187777 |
0.9423 | High Similarity | NPC477201 |
0.9423 | High Similarity | NPC18951 |
0.94 | High Similarity | NPC92114 |
0.9388 | High Similarity | NPC224227 |
0.9245 | High Similarity | NPC225929 |
0.9231 | High Similarity | NPC473863 |
0.9231 | High Similarity | NPC274290 |
0.9231 | High Similarity | NPC54766 |
0.92 | High Similarity | NPC262968 |
0.9184 | High Similarity | NPC5413 |
0.9184 | High Similarity | NPC149821 |
0.9 | High Similarity | NPC59051 |
0.898 | High Similarity | NPC180534 |
0.898 | High Similarity | NPC207292 |
0.8909 | High Similarity | NPC274927 |
0.8909 | High Similarity | NPC106851 |
0.8846 | High Similarity | NPC309606 |
0.8846 | High Similarity | NPC139545 |
0.8846 | High Similarity | NPC39633 |
0.875 | High Similarity | NPC122521 |
0.875 | High Similarity | NPC251042 |
0.875 | High Similarity | NPC235242 |
0.875 | High Similarity | NPC243532 |
0.875 | High Similarity | NPC174447 |
0.8654 | High Similarity | NPC18357 |
0.86 | High Similarity | NPC91495 |
0.8596 | High Similarity | NPC201939 |
0.8596 | High Similarity | NPC40082 |
0.8571 | High Similarity | NPC117572 |
0.8519 | High Similarity | NPC10316 |
0.8519 | High Similarity | NPC223677 |
0.8519 | High Similarity | NPC28779 |
0.8519 | High Similarity | NPC128061 |
0.8519 | High Similarity | NPC228473 |
0.8519 | High Similarity | NPC200845 |
0.8491 | Intermediate Similarity | NPC71761 |
0.8462 | Intermediate Similarity | NPC28205 |
0.8462 | Intermediate Similarity | NPC284212 |
0.8462 | Intermediate Similarity | NPC470412 |
0.8462 | Intermediate Similarity | NPC470410 |
0.8393 | Intermediate Similarity | NPC267817 |
0.8393 | Intermediate Similarity | NPC34416 |
0.8333 | Intermediate Similarity | NPC87394 |
0.8305 | Intermediate Similarity | NPC328089 |
0.8305 | Intermediate Similarity | NPC68343 |
0.8305 | Intermediate Similarity | NPC470320 |
0.8276 | Intermediate Similarity | NPC174560 |
0.8276 | Intermediate Similarity | NPC125312 |
0.8235 | Intermediate Similarity | NPC216130 |
0.8182 | Intermediate Similarity | NPC52264 |
0.8167 | Intermediate Similarity | NPC245947 |
0.8167 | Intermediate Similarity | NPC326268 |
0.8167 | Intermediate Similarity | NPC136164 |
0.8167 | Intermediate Similarity | NPC255863 |
0.8167 | Intermediate Similarity | NPC318420 |
0.8113 | Intermediate Similarity | NPC48162 |
0.8036 | Intermediate Similarity | NPC325977 |
0.8 | Intermediate Similarity | NPC137538 |
0.8 | Intermediate Similarity | NPC226592 |
0.7966 | Intermediate Similarity | NPC328776 |
0.7966 | Intermediate Similarity | NPC320305 |
0.7966 | Intermediate Similarity | NPC321838 |
0.7963 | Intermediate Similarity | NPC161366 |
0.7903 | Intermediate Similarity | NPC148192 |
0.7903 | Intermediate Similarity | NPC26500 |
0.7903 | Intermediate Similarity | NPC271921 |
0.7903 | Intermediate Similarity | NPC127091 |
0.7903 | Intermediate Similarity | NPC104537 |
0.7903 | Intermediate Similarity | NPC330426 |
0.7903 | Intermediate Similarity | NPC22101 |
0.7903 | Intermediate Similarity | NPC99619 |
0.7857 | Intermediate Similarity | NPC45626 |
0.78 | Intermediate Similarity | NPC270796 |
0.7797 | Intermediate Similarity | NPC143857 |
0.7797 | Intermediate Similarity | NPC229252 |
0.7778 | Intermediate Similarity | NPC48218 |
0.7778 | Intermediate Similarity | NPC324981 |
0.7778 | Intermediate Similarity | NPC476614 |
0.7778 | Intermediate Similarity | NPC141481 |
0.7778 | Intermediate Similarity | NPC473559 |
0.7759 | Intermediate Similarity | NPC329819 |
0.7736 | Intermediate Similarity | NPC207815 |
0.7705 | Intermediate Similarity | NPC234767 |
0.7692 | Intermediate Similarity | NPC42304 |
0.7679 | Intermediate Similarity | NPC322461 |
0.7667 | Intermediate Similarity | NPC477829 |
0.7656 | Intermediate Similarity | NPC317583 |
0.7656 | Intermediate Similarity | NPC143396 |
0.7636 | Intermediate Similarity | NPC129458 |
0.7627 | Intermediate Similarity | NPC329550 |
0.7619 | Intermediate Similarity | NPC473829 |
0.7619 | Intermediate Similarity | NPC475443 |
0.7619 | Intermediate Similarity | NPC60120 |
0.7541 | Intermediate Similarity | NPC477707 |
0.7541 | Intermediate Similarity | NPC54925 |
0.7538 | Intermediate Similarity | NPC476660 |
0.7538 | Intermediate Similarity | NPC42526 |
0.75 | Intermediate Similarity | NPC53302 |
0.75 | Intermediate Similarity | NPC10081 |
0.75 | Intermediate Similarity | NPC225066 |
0.75 | Intermediate Similarity | NPC328311 |
0.75 | Intermediate Similarity | NPC327112 |
0.746 | Intermediate Similarity | NPC308294 |
0.746 | Intermediate Similarity | NPC142423 |
0.7455 | Intermediate Similarity | NPC477458 |
0.7414 | Intermediate Similarity | NPC327388 |
0.7407 | Intermediate Similarity | NPC163345 |
0.74 | Intermediate Similarity | NPC209970 |
0.74 | Intermediate Similarity | NPC196924 |
0.74 | Intermediate Similarity | NPC307783 |
0.74 | Intermediate Similarity | NPC216630 |
0.74 | Intermediate Similarity | NPC149184 |
0.74 | Intermediate Similarity | NPC171736 |
0.7385 | Intermediate Similarity | NPC473772 |
0.7347 | Intermediate Similarity | NPC279026 |
0.7347 | Intermediate Similarity | NPC301585 |
0.7347 | Intermediate Similarity | NPC154186 |
0.7347 | Intermediate Similarity | NPC113928 |
0.7347 | Intermediate Similarity | NPC301696 |
0.7347 | Intermediate Similarity | NPC261080 |
0.7347 | Intermediate Similarity | NPC201844 |
0.7347 | Intermediate Similarity | NPC14227 |
0.7321 | Intermediate Similarity | NPC303765 |
0.7288 | Intermediate Similarity | NPC211752 |
0.7288 | Intermediate Similarity | NPC323597 |
0.7288 | Intermediate Similarity | NPC323498 |
0.7288 | Intermediate Similarity | NPC323436 |
0.7258 | Intermediate Similarity | NPC477830 |
0.7255 | Intermediate Similarity | NPC67462 |
0.7241 | Intermediate Similarity | NPC474672 |
0.7241 | Intermediate Similarity | NPC477984 |
0.7206 | Intermediate Similarity | NPC3753 |
0.7206 | Intermediate Similarity | NPC251970 |
0.7206 | Intermediate Similarity | NPC183503 |
0.7206 | Intermediate Similarity | NPC227396 |
0.7206 | Intermediate Similarity | NPC474321 |
0.7206 | Intermediate Similarity | NPC237591 |
0.7206 | Intermediate Similarity | NPC241854 |
0.7206 | Intermediate Similarity | NPC161923 |
0.7206 | Intermediate Similarity | NPC283908 |
0.7206 | Intermediate Similarity | NPC55527 |
0.7206 | Intermediate Similarity | NPC476046 |
0.7206 | Intermediate Similarity | NPC103958 |
0.717 | Intermediate Similarity | NPC239754 |
0.717 | Intermediate Similarity | NPC76976 |
0.7167 | Intermediate Similarity | NPC469373 |
0.7164 | Intermediate Similarity | NPC288667 |
0.7164 | Intermediate Similarity | NPC320119 |
0.7164 | Intermediate Similarity | NPC320669 |
0.7164 | Intermediate Similarity | NPC318814 |
0.7164 | Intermediate Similarity | NPC160817 |
0.7143 | Intermediate Similarity | NPC178586 |
0.7115 | Intermediate Similarity | NPC252978 |
0.7115 | Intermediate Similarity | NPC74845 |
0.7115 | Intermediate Similarity | NPC19305 |
0.7115 | Intermediate Similarity | NPC255837 |
0.7101 | Intermediate Similarity | NPC476844 |
0.7101 | Intermediate Similarity | NPC192540 |
0.7101 | Intermediate Similarity | NPC279666 |
0.7097 | Intermediate Similarity | NPC113293 |
0.7077 | Intermediate Similarity | NPC472875 |
0.7059 | Intermediate Similarity | NPC325627 |
0.7059 | Intermediate Similarity | NPC326024 |
0.7049 | Intermediate Similarity | NPC329249 |
0.7037 | Intermediate Similarity | NPC110234 |
0.7037 | Intermediate Similarity | NPC163751 |
0.7037 | Intermediate Similarity | NPC44363 |
0.7031 | Intermediate Similarity | NPC320642 |
0.7031 | Intermediate Similarity | NPC476657 |
0.7031 | Intermediate Similarity | NPC476654 |
0.7031 | Intermediate Similarity | NPC317881 |
0.7031 | Intermediate Similarity | NPC476655 |
0.7031 | Intermediate Similarity | NPC323045 |
0.7018 | Intermediate Similarity | NPC310746 |
0.7018 | Intermediate Similarity | NPC216407 |
0.7015 | Intermediate Similarity | NPC67183 |
0.7 | Intermediate Similarity | NPC469514 |
0.7 | Intermediate Similarity | NPC69143 |
0.7 | Intermediate Similarity | NPC214610 |
0.7 | Intermediate Similarity | NPC118968 |
0.7 | Intermediate Similarity | NPC281230 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC1813 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 |
---|---|---|---|
1.0 | High Similarity | NPD3172 | Approved |
0.98 | High Similarity | NPD3194 | Approved |
0.98 | High Similarity | NPD3196 | Approved |
0.98 | High Similarity | NPD4266 | Approved |
0.98 | High Similarity | NPD3195 | Phase 2 |
0.92 | High Similarity | NPD29 | Approved |
0.92 | High Similarity | NPD28 | Approved |
0.9184 | High Similarity | NPD3173 | Approved |
0.898 | High Similarity | NPD622 | Approved |
0.8571 | High Similarity | NPD3174 | Discontinued |
0.8571 | High Similarity | NPD4222 | Approved |
0.8305 | Intermediate Similarity | NPD3197 | Phase 1 |
0.82 | Intermediate Similarity | NPD39 | Approved |
0.78 | Intermediate Similarity | NPD5326 | Phase 3 |
0.75 | Intermediate Similarity | NPD4246 | Clinical (unspecified phase) |
0.74 | Intermediate Similarity | NPD2270 | Approved |
0.7347 | Intermediate Similarity | NPD9448 | Phase 2 |
0.7347 | Intermediate Similarity | NPD633 | Phase 3 |
0.7222 | Intermediate Similarity | NPD5343 | Approved |
0.7 | Intermediate Similarity | NPD9655 | Approved |
0.6984 | Remote Similarity | NPD2664 | Clinical (unspecified phase) |
0.6981 | Remote Similarity | NPD3199 | Clinical (unspecified phase) |
0.6923 | Remote Similarity | NPD7331 | Phase 2 |
0.6818 | Remote Similarity | NPD4247 | Clinical (unspecified phase) |
0.6806 | Remote Similarity | NPD3732 | Approved |
0.68 | Remote Similarity | NPD3206 | Approved |
0.6667 | Remote Similarity | NPD4756 | Discovery |
0.6667 | Remote Similarity | NPD6096 | Approved |
0.6667 | Remote Similarity | NPD6097 | Approved |
0.6622 | Remote Similarity | NPD5368 | Approved |
0.6613 | Remote Similarity | NPD6109 | Phase 1 |
0.6575 | Remote Similarity | NPD5784 | Clinical (unspecified phase) |
0.6545 | Remote Similarity | NPD634 | Phase 3 |
0.6533 | Remote Similarity | NPD5369 | Approved |
0.6447 | Remote Similarity | NPD6435 | Approved |
0.6447 | Remote Similarity | NPD4269 | Approved |
0.6447 | Remote Similarity | NPD4270 | Approved |
0.6418 | Remote Similarity | NPD6108 | Clinical (unspecified phase) |
0.64 | Remote Similarity | NPD4252 | Approved |
0.6389 | Remote Similarity | NPD8039 | Approved |
0.6364 | Remote Similarity | NPD7154 | Phase 3 |
0.6364 | Remote Similarity | NPD5362 | Discontinued |
0.6351 | Remote Similarity | NPD4268 | Approved |
0.6351 | Remote Similarity | NPD4271 | Approved |
0.6269 | Remote Similarity | NPD7341 | Phase 2 |
0.6207 | Remote Similarity | NPD4220 | Pre-registration |
0.6203 | Remote Similarity | NPD5363 | Approved |
0.6184 | Remote Similarity | NPD4822 | Approved |
0.6184 | Remote Similarity | NPD4819 | Approved |
0.6184 | Remote Similarity | NPD5790 | Clinical (unspecified phase) |
0.6184 | Remote Similarity | NPD4821 | Approved |
0.6184 | Remote Similarity | NPD4820 | Approved |
0.6176 | Remote Similarity | NPD3704 | Approved |
0.6167 | Remote Similarity | NPD3186 | Phase 1 |
0.6125 | Remote Similarity | NPD5786 | Approved |
0.6104 | Remote Similarity | NPD857 | Phase 3 |
0.6071 | Remote Similarity | NPD2699 | Approved |
0.6 | Remote Similarity | NPD6927 | Phase 3 |
0.6 | Remote Similarity | NPD387 | Clinical (unspecified phase) |
0.5968 | Remote Similarity | NPD3728 | Approved |
0.5968 | Remote Similarity | NPD3730 | Approved |
0.5968 | Remote Similarity | NPD3729 | Clinical (unspecified phase) |
0.5965 | Remote Similarity | NPD9431 | Approved |
0.5965 | Remote Similarity | NPD9430 | Approved |
0.5949 | Remote Similarity | NPD5331 | Approved |
0.5949 | Remote Similarity | NPD5332 | Approved |
0.5904 | Remote Similarity | NPD6101 | Approved |
0.5904 | Remote Similarity | NPD5347 | Phase 2 |
0.5904 | Remote Similarity | NPD5346 | Phase 2 |
0.5904 | Remote Similarity | NPD5764 | Clinical (unspecified phase) |
0.5897 | Remote Similarity | NPD226 | Approved |
0.5897 | Remote Similarity | NPD4790 | Discontinued |
0.5873 | Remote Similarity | NPD4627 | Clinical (unspecified phase) |
0.5854 | Remote Similarity | NPD4793 | Discontinued |
0.5833 | Remote Similarity | NPD5785 | Approved |
0.5821 | Remote Similarity | NPD4193 | Approved |
0.5821 | Remote Similarity | NPD4191 | Approved |
0.5821 | Remote Similarity | NPD4192 | Approved |
0.5821 | Remote Similarity | NPD4194 | Approved |
0.5769 | Remote Similarity | NPD4695 | Discontinued |
0.5765 | Remote Similarity | NPD6411 | Approved |
0.5765 | Remote Similarity | NPD5281 | Approved |
0.5765 | Remote Similarity | NPD5284 | Approved |
0.5765 | Remote Similarity | NPD7983 | Approved |
0.575 | Remote Similarity | NPD9491 | Approved |
0.5741 | Remote Similarity | NPD77 | Approved |
0.5741 | Remote Similarity | NPD9450 | Approved |
0.5741 | Remote Similarity | NPD5783 | Phase 3 |
0.5732 | Remote Similarity | NPD6422 | Discontinued |
0.5732 | Remote Similarity | NPD4249 | Approved |
0.5714 | Remote Similarity | NPD800 | Approved |
0.5714 | Remote Similarity | NPD615 | Clinical (unspecified phase) |
0.5714 | Remote Similarity | NPD5370 | Suspended |
0.5698 | Remote Similarity | NPD5779 | Approved |
0.5698 | Remote Similarity | NPD5778 | Approved |
0.569 | Remote Similarity | NPD4265 | Approved |
0.5663 | Remote Similarity | NPD4250 | Approved |
0.5663 | Remote Similarity | NPD4251 | Approved |
0.5647 | Remote Similarity | NPD1086 | Approved |
0.5647 | Remote Similarity | NPD6698 | Approved |
0.5647 | Remote Similarity | NPD46 | Approved |
0.5647 | Remote Similarity | NPD1089 | Approved |
0.5647 | Remote Similarity | NPD1090 | Approved |
0.5632 | Remote Similarity | NPD5122 | Clinical (unspecified phase) |
0.5625 | Remote Similarity | NPD4752 | Clinical (unspecified phase) |
0.5625 | Remote Similarity | NPD4221 | Approved |
0.5625 | Remote Similarity | NPD4223 | Phase 3 |
0.5625 | Remote Similarity | NPD3667 | Approved |
0.5614 | Remote Similarity | NPD9411 | Phase 1 |
PubChem CID   | 860 |
ChEMBL   | CHEMBL3560296 |
ZINC   |
Molecular Weight:   | 278.22 |
ALogP:   | -0.0979 |
MLogP:   | 3.22 |
XLogP:   | 7.538 |
# Rotatable Bonds:   | 15 |
Polar Surface Area:   | 37.3 |
# H-Bond Aceptor:   | 2 |
# H-Bond Donor:   | 1 |
# Rings:   | 0 |
# Heavy Atoms:   | 20 |