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 NPC44682 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 | NPC163409 |
0.977 | High Similarity | NPC477349 |
0.9551 | High Similarity | NPC477345 |
0.9551 | High Similarity | NPC477348 |
0.9551 | High Similarity | NPC238264 |
0.9341 | High Similarity | NPC475375 |
0.9341 | High Similarity | NPC473605 |
0.9341 | High Similarity | NPC475525 |
0.9341 | High Similarity | NPC476066 |
0.9341 | High Similarity | NPC475164 |
0.9341 | High Similarity | NPC475241 |
0.9341 | High Similarity | NPC475540 |
0.9341 | High Similarity | NPC475593 |
0.9341 | High Similarity | NPC473765 |
0.8539 | High Similarity | NPC288471 |
0.8298 | Intermediate Similarity | NPC110072 |
0.8295 | Intermediate Similarity | NPC267592 |
0.8276 | Intermediate Similarity | NPC477325 |
0.8276 | Intermediate Similarity | NPC477323 |
0.8276 | Intermediate Similarity | NPC475425 |
0.8276 | Intermediate Similarity | NPC109887 |
0.8276 | Intermediate Similarity | NPC477330 |
0.8276 | Intermediate Similarity | NPC477320 |
0.8276 | Intermediate Similarity | NPC113745 |
0.8276 | Intermediate Similarity | NPC281563 |
0.8276 | Intermediate Similarity | NPC477329 |
0.8276 | Intermediate Similarity | NPC477328 |
0.8276 | Intermediate Similarity | NPC477326 |
0.8276 | Intermediate Similarity | NPC146380 |
0.8202 | Intermediate Similarity | NPC477319 |
0.8202 | Intermediate Similarity | NPC184915 |
0.8202 | Intermediate Similarity | NPC169345 |
0.8202 | Intermediate Similarity | NPC472200 |
0.8202 | Intermediate Similarity | NPC472202 |
0.8202 | Intermediate Similarity | NPC224953 |
0.8202 | Intermediate Similarity | NPC472204 |
0.8202 | Intermediate Similarity | NPC123204 |
0.8202 | Intermediate Similarity | NPC472201 |
0.8202 | Intermediate Similarity | NPC183888 |
0.8202 | Intermediate Similarity | NPC477331 |
0.8202 | Intermediate Similarity | NPC477318 |
0.8202 | Intermediate Similarity | NPC472203 |
0.8202 | Intermediate Similarity | NPC143421 |
0.8202 | Intermediate Similarity | NPC89843 |
0.8202 | Intermediate Similarity | NPC307400 |
0.8202 | Intermediate Similarity | NPC27289 |
0.8202 | Intermediate Similarity | NPC126685 |
0.8202 | Intermediate Similarity | NPC44782 |
0.8202 | Intermediate Similarity | NPC119583 |
0.8202 | Intermediate Similarity | NPC472205 |
0.8202 | Intermediate Similarity | NPC259294 |
0.8202 | Intermediate Similarity | NPC290012 |
0.8202 | Intermediate Similarity | NPC477317 |
0.8202 | Intermediate Similarity | NPC115013 |
0.8085 | Intermediate Similarity | NPC285588 |
0.8046 | Intermediate Similarity | NPC477350 |
0.8022 | Intermediate Similarity | NPC477332 |
0.8022 | Intermediate Similarity | NPC60849 |
0.8022 | Intermediate Similarity | NPC472352 |
0.7978 | Intermediate Similarity | NPC146992 |
0.7978 | Intermediate Similarity | NPC294748 |
0.7978 | Intermediate Similarity | NPC22742 |
0.7978 | Intermediate Similarity | NPC85759 |
0.7978 | Intermediate Similarity | NPC477344 |
0.7978 | Intermediate Similarity | NPC477346 |
0.7978 | Intermediate Similarity | NPC158302 |
0.7955 | Intermediate Similarity | NPC476783 |
0.7955 | Intermediate Similarity | NPC476781 |
0.7955 | Intermediate Similarity | NPC216883 |
0.7955 | Intermediate Similarity | NPC476782 |
0.7864 | Intermediate Similarity | NPC315070 |
0.7835 | Intermediate Similarity | NPC320089 |
0.7822 | Intermediate Similarity | NPC154132 |
0.7822 | Intermediate Similarity | NPC57586 |
0.7822 | Intermediate Similarity | NPC2313 |
0.7822 | Intermediate Similarity | NPC475655 |
0.7822 | Intermediate Similarity | NPC475157 |
0.7822 | Intermediate Similarity | NPC471637 |
0.7802 | Intermediate Similarity | NPC476087 |
0.7802 | Intermediate Similarity | NPC475270 |
0.7802 | Intermediate Similarity | NPC475667 |
0.7802 | Intermediate Similarity | NPC475327 |
0.7802 | Intermediate Similarity | NPC238056 |
0.7802 | Intermediate Similarity | NPC297768 |
0.7802 | Intermediate Similarity | NPC186992 |
0.7802 | Intermediate Similarity | NPC269318 |
0.7802 | Intermediate Similarity | NPC173328 |
0.7802 | Intermediate Similarity | NPC477347 |
0.7701 | Intermediate Similarity | NPC9763 |
0.7701 | Intermediate Similarity | NPC39266 |
0.7701 | Intermediate Similarity | NPC225748 |
0.7701 | Intermediate Similarity | NPC169085 |
0.7701 | Intermediate Similarity | NPC206823 |
0.7701 | Intermediate Similarity | NPC163812 |
0.7684 | Intermediate Similarity | NPC475186 |
0.7684 | Intermediate Similarity | NPC118077 |
0.7634 | Intermediate Similarity | NPC38295 |
0.7634 | Intermediate Similarity | NPC470313 |
0.7634 | Intermediate Similarity | NPC156089 |
0.7634 | Intermediate Similarity | NPC473500 |
0.76 | Intermediate Similarity | NPC143446 |
0.7576 | Intermediate Similarity | NPC159698 |
0.7565 | Intermediate Similarity | NPC297950 |
0.7547 | Intermediate Similarity | NPC193765 |
0.7524 | Intermediate Similarity | NPC476738 |
0.7524 | Intermediate Similarity | NPC476740 |
0.75 | Intermediate Similarity | NPC474581 |
0.75 | Intermediate Similarity | NPC469543 |
0.75 | Intermediate Similarity | NPC309398 |
0.75 | Intermediate Similarity | NPC127295 |
0.75 | Intermediate Similarity | NPC163362 |
0.75 | Intermediate Similarity | NPC125142 |
0.75 | Intermediate Similarity | NPC297945 |
0.75 | Intermediate Similarity | NPC126897 |
0.75 | Intermediate Similarity | NPC473816 |
0.75 | Intermediate Similarity | NPC475367 |
0.75 | Intermediate Similarity | NPC197736 |
0.7475 | Intermediate Similarity | NPC472195 |
0.7475 | Intermediate Similarity | NPC238090 |
0.7475 | Intermediate Similarity | NPC472196 |
0.7471 | Intermediate Similarity | NPC52268 |
0.7471 | Intermediate Similarity | NPC53760 |
0.7436 | Intermediate Similarity | NPC23020 |
0.7436 | Intermediate Similarity | NPC220838 |
0.7436 | Intermediate Similarity | NPC472268 |
0.7436 | Intermediate Similarity | NPC472269 |
0.7436 | Intermediate Similarity | NPC472270 |
0.7436 | Intermediate Similarity | NPC112492 |
0.7436 | Intermediate Similarity | NPC45606 |
0.7434 | Intermediate Similarity | NPC476150 |
0.7434 | Intermediate Similarity | NPC476127 |
0.7419 | Intermediate Similarity | NPC469469 |
0.7419 | Intermediate Similarity | NPC21693 |
0.7419 | Intermediate Similarity | NPC236649 |
0.74 | Intermediate Similarity | NPC294293 |
0.7396 | Intermediate Similarity | NPC47937 |
0.7383 | Intermediate Similarity | NPC177524 |
0.7383 | Intermediate Similarity | NPC392 |
0.7383 | Intermediate Similarity | NPC219900 |
0.7373 | Intermediate Similarity | NPC28069 |
0.7373 | Intermediate Similarity | NPC77651 |
0.7356 | Intermediate Similarity | NPC211428 |
0.7356 | Intermediate Similarity | NPC241265 |
0.7356 | Intermediate Similarity | NPC285003 |
0.735 | Intermediate Similarity | NPC470516 |
0.7345 | Intermediate Similarity | NPC470915 |
0.7345 | Intermediate Similarity | NPC470911 |
0.7345 | Intermediate Similarity | NPC470517 |
0.7311 | Intermediate Similarity | NPC290276 |
0.7311 | Intermediate Similarity | NPC300655 |
0.7311 | Intermediate Similarity | NPC198918 |
0.7311 | Intermediate Similarity | NPC204214 |
0.7311 | Intermediate Similarity | NPC124878 |
0.7311 | Intermediate Similarity | NPC92283 |
0.7311 | Intermediate Similarity | NPC147032 |
0.7311 | Intermediate Similarity | NPC10121 |
0.7311 | Intermediate Similarity | NPC222951 |
0.7311 | Intermediate Similarity | NPC10883 |
0.7311 | Intermediate Similarity | NPC43589 |
0.7311 | Intermediate Similarity | NPC231888 |
0.7311 | Intermediate Similarity | NPC35338 |
0.7311 | Intermediate Similarity | NPC63404 |
0.7311 | Intermediate Similarity | NPC311178 |
0.7308 | Intermediate Similarity | NPC476611 |
0.73 | Intermediate Similarity | NPC475173 |
0.73 | Intermediate Similarity | NPC473663 |
0.73 | Intermediate Similarity | NPC473561 |
0.73 | Intermediate Similarity | NPC473520 |
0.73 | Intermediate Similarity | NPC473723 |
0.7292 | Intermediate Similarity | NPC329615 |
0.7292 | Intermediate Similarity | NPC471567 |
0.7292 | Intermediate Similarity | NPC182383 |
0.7292 | Intermediate Similarity | NPC477013 |
0.7292 | Intermediate Similarity | NPC470124 |
0.7292 | Intermediate Similarity | NPC120398 |
0.7292 | Intermediate Similarity | NPC477014 |
0.7292 | Intermediate Similarity | NPC329838 |
0.7288 | Intermediate Similarity | NPC162925 |
0.7288 | Intermediate Similarity | NPC87153 |
0.7273 | Intermediate Similarity | NPC473311 |
0.7273 | Intermediate Similarity | NPC473904 |
0.7264 | Intermediate Similarity | NPC231271 |
0.7264 | Intermediate Similarity | NPC470519 |
0.7257 | Intermediate Similarity | NPC471548 |
0.7257 | Intermediate Similarity | NPC470515 |
0.7255 | Intermediate Similarity | NPC306041 |
0.725 | Intermediate Similarity | NPC319719 |
0.725 | Intermediate Similarity | NPC233223 |
0.725 | Intermediate Similarity | NPC322904 |
0.725 | Intermediate Similarity | NPC324933 |
0.725 | Intermediate Similarity | NPC196874 |
0.725 | Intermediate Similarity | NPC471025 |
0.725 | Intermediate Similarity | NPC475444 |
0.725 | Intermediate Similarity | NPC183816 |
0.725 | Intermediate Similarity | NPC475177 |
0.725 | Intermediate Similarity | NPC473679 |
0.7245 | Intermediate Similarity | NPC89001 |
0.7245 | Intermediate Similarity | NPC473905 |
0.7245 | Intermediate Similarity | NPC40376 |
0.7245 | Intermediate Similarity | NPC320458 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC44682 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 |
---|---|---|---|
0.75 | Intermediate Similarity | NPD8413 | Clinical (unspecified phase) |
0.7383 | Intermediate Similarity | NPD6686 | Approved |
0.71 | Intermediate Similarity | NPD6698 | Approved |
0.71 | Intermediate Similarity | NPD46 | Approved |
0.7069 | Intermediate Similarity | NPD8516 | Approved |
0.7069 | Intermediate Similarity | NPD8515 | Approved |
0.7069 | Intermediate Similarity | NPD8517 | Approved |
0.7054 | Intermediate Similarity | NPD8133 | Approved |
0.6952 | Remote Similarity | NPD8029 | Clinical (unspecified phase) |
0.6923 | Remote Similarity | NPD8513 | Phase 3 |
0.6842 | Remote Similarity | NPD7329 | Approved |
0.6555 | Remote Similarity | NPD8377 | Approved |
0.6555 | Remote Similarity | NPD8294 | Approved |
0.6529 | Remote Similarity | NPD8328 | Phase 3 |
0.6529 | Remote Similarity | NPD7830 | Approved |
0.6529 | Remote Similarity | NPD7829 | Approved |
0.65 | Remote Similarity | NPD8378 | Approved |
0.65 | Remote Similarity | NPD8379 | Approved |
0.65 | Remote Similarity | NPD8296 | Approved |
0.65 | Remote Similarity | NPD8380 | Approved |
0.65 | Remote Similarity | NPD8335 | Approved |
0.6442 | Remote Similarity | NPD7838 | Discovery |
0.6437 | Remote Similarity | NPD6123 | Approved |
0.6423 | Remote Similarity | NPD7507 | Approved |
0.6372 | Remote Similarity | NPD6412 | Phase 2 |
0.6364 | Remote Similarity | NPD8033 | Approved |
0.627 | Remote Similarity | NPD7319 | Approved |
0.6261 | Remote Similarity | NPD8132 | Clinical (unspecified phase) |
0.623 | Remote Similarity | NPD7503 | Approved |
0.6226 | Remote Similarity | NPD7983 | Approved |
0.6116 | Remote Similarity | NPD7328 | Approved |
0.6116 | Remote Similarity | NPD7327 | Approved |
0.6111 | Remote Similarity | NPD8448 | Approved |
0.6098 | Remote Similarity | NPD8444 | Approved |
0.6094 | Remote Similarity | NPD8391 | Approved |
0.6094 | Remote Similarity | NPD8392 | Approved |
0.6094 | Remote Similarity | NPD8390 | Approved |
0.6087 | Remote Similarity | NPD7899 | Clinical (unspecified phase) |
0.6066 | Remote Similarity | NPD7516 | Approved |
0.6042 | Remote Similarity | NPD3181 | Approved |
0.6033 | Remote Similarity | NPD8295 | Clinical (unspecified phase) |
0.6032 | Remote Similarity | NPD8451 | Approved |
0.6 | Remote Similarity | NPD7642 | Approved |
0.5984 | Remote Similarity | NPD7641 | Discontinued |
0.5984 | Remote Similarity | NPD8074 | Phase 3 |
0.5913 | Remote Similarity | NPD8170 | Clinical (unspecified phase) |
0.5856 | Remote Similarity | NPD7839 | Suspended |
0.5851 | Remote Similarity | NPD898 | Approved |
0.5851 | Remote Similarity | NPD896 | Approved |
0.5851 | Remote Similarity | NPD897 | Approved |
0.5827 | Remote Similarity | NPD8341 | Approved |
0.5827 | Remote Similarity | NPD8299 | Approved |
0.5827 | Remote Similarity | NPD8340 | Approved |
0.5827 | Remote Similarity | NPD8342 | Approved |
0.5798 | Remote Similarity | NPD6371 | Approved |
0.5747 | Remote Similarity | NPD3728 | Approved |
0.5747 | Remote Similarity | NPD3730 | Approved |
0.5747 | Remote Similarity | NPD7346 | Approved |
0.5739 | Remote Similarity | NPD8082 | Approved |
0.5739 | Remote Similarity | NPD8085 | Approved |
0.5739 | Remote Similarity | NPD8086 | Approved |
0.5739 | Remote Similarity | NPD8139 | Approved |
0.5739 | Remote Similarity | NPD8084 | Approved |
0.5739 | Remote Similarity | NPD8083 | Approved |
0.5739 | Remote Similarity | NPD8138 | Approved |
0.5726 | Remote Similarity | NPD8393 | Approved |
0.5714 | Remote Similarity | NPD6400 | Clinical (unspecified phase) |
0.5704 | Remote Similarity | NPD7966 | Clinical (unspecified phase) |
0.5692 | Remote Similarity | NPD7736 | Approved |
0.569 | Remote Similarity | NPD8275 | Approved |
0.569 | Remote Similarity | NPD8276 | Approved |
0.5688 | Remote Similarity | NPD8522 | Clinical (unspecified phase) |
0.5669 | Remote Similarity | NPD8080 | Discontinued |
0.5652 | Remote Similarity | NPD5344 | Discontinued |
0.5645 | Remote Similarity | NPD8137 | Clinical (unspecified phase) |
0.5641 | Remote Similarity | NPD8081 | Approved |
0.5632 | Remote Similarity | NPD888 | Phase 3 |
0.5632 | Remote Similarity | NPD893 | Approved |
0.5632 | Remote Similarity | NPD890 | Clinical (unspecified phase) |
0.5632 | Remote Similarity | NPD891 | Phase 3 |
0.5632 | Remote Similarity | NPD892 | Phase 3 |
0.5614 | Remote Similarity | NPD7638 | Approved |
0.5603 | Remote Similarity | NPD7139 | Approved |
0.5603 | Remote Similarity | NPD7141 | Clinical (unspecified phase) |
0.5603 | Remote Similarity | NPD7140 | Approved |
PubChem CID   | 71451029 |
ChEMBL   | CHEMBL2146620 |
ZINC   |
Molecular Weight:   | 1164.59 |
ALogP:   | -6.8001 |
MLogP:   | 4.87 |
XLogP:   | 4.048 |
# Rotatable Bonds:   | 35 |
Polar Surface Area:   | 353.27 |
# H-Bond Aceptor:   | 25 |
# H-Bond Donor:   | 9 |
# Rings:   | 6 |
# Heavy Atoms:   | 81 |