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 NPC475946 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 |
---|---|---|
0.9024 | High Similarity | NPC233997 |
0.9012 | High Similarity | NPC471480 |
0.7865 | Intermediate Similarity | NPC66504 |
0.7816 | Intermediate Similarity | NPC74139 |
0.7727 | Intermediate Similarity | NPC473151 |
0.7722 | Intermediate Similarity | NPC477084 |
0.7609 | Intermediate Similarity | NPC291709 |
0.7609 | Intermediate Similarity | NPC241407 |
0.7527 | Intermediate Similarity | NPC284063 |
0.7468 | Intermediate Similarity | NPC269841 |
0.7447 | Intermediate Similarity | NPC86843 |
0.7447 | Intermediate Similarity | NPC153559 |
0.7412 | Intermediate Similarity | NPC474739 |
0.7381 | Intermediate Similarity | NPC264610 |
0.7368 | Intermediate Similarity | NPC90819 |
0.7368 | Intermediate Similarity | NPC124181 |
0.7368 | Intermediate Similarity | NPC473307 |
0.7356 | Intermediate Similarity | NPC475842 |
0.7312 | Intermediate Similarity | NPC274588 |
0.7262 | Intermediate Similarity | NPC84360 |
0.7241 | Intermediate Similarity | NPC475936 |
0.7234 | Intermediate Similarity | NPC93869 |
0.7234 | Intermediate Similarity | NPC6765 |
0.7229 | Intermediate Similarity | NPC93213 |
0.7216 | Intermediate Similarity | NPC476228 |
0.7204 | Intermediate Similarity | NPC163902 |
0.7204 | Intermediate Similarity | NPC12297 |
0.7159 | Intermediate Similarity | NPC53867 |
0.7158 | Intermediate Similarity | NPC170527 |
0.7071 | Intermediate Similarity | NPC329834 |
0.7045 | Intermediate Similarity | NPC103171 |
0.7033 | Intermediate Similarity | NPC474765 |
0.7024 | Intermediate Similarity | NPC475861 |
0.7021 | Intermediate Similarity | NPC474835 |
0.7011 | Intermediate Similarity | NPC190008 |
0.701 | Intermediate Similarity | NPC151093 |
0.7 | Intermediate Similarity | NPC474547 |
0.6988 | Remote Similarity | NPC12680 |
0.6977 | Remote Similarity | NPC474341 |
0.6966 | Remote Similarity | NPC231601 |
0.6966 | Remote Similarity | NPC127917 |
0.6957 | Remote Similarity | NPC144069 |
0.6947 | Remote Similarity | NPC88507 |
0.6941 | Remote Similarity | NPC301525 |
0.6939 | Remote Similarity | NPC244878 |
0.6939 | Remote Similarity | NPC476320 |
0.6939 | Remote Similarity | NPC476211 |
0.6907 | Remote Similarity | NPC198549 |
0.6907 | Remote Similarity | NPC113976 |
0.6907 | Remote Similarity | NPC97867 |
0.6897 | Remote Similarity | NPC323472 |
0.6889 | Remote Similarity | NPC471367 |
0.6875 | Remote Similarity | NPC472189 |
0.6875 | Remote Similarity | NPC471372 |
0.6875 | Remote Similarity | NPC471362 |
0.6869 | Remote Similarity | NPC20673 |
0.6869 | Remote Similarity | NPC4637 |
0.6869 | Remote Similarity | NPC476230 |
0.6869 | Remote Similarity | NPC27474 |
0.6869 | Remote Similarity | NPC216911 |
0.6869 | Remote Similarity | NPC219038 |
0.6869 | Remote Similarity | NPC98859 |
0.6854 | Remote Similarity | NPC10080 |
0.6854 | Remote Similarity | NPC123908 |
0.6848 | Remote Similarity | NPC475087 |
0.6837 | Remote Similarity | NPC279561 |
0.6827 | Remote Similarity | NPC193741 |
0.6818 | Remote Similarity | NPC469802 |
0.6813 | Remote Similarity | NPC471494 |
0.6813 | Remote Similarity | NPC472442 |
0.6809 | Remote Similarity | NPC202886 |
0.6809 | Remote Similarity | NPC117596 |
0.6804 | Remote Similarity | NPC311166 |
0.6804 | Remote Similarity | NPC94905 |
0.6804 | Remote Similarity | NPC171598 |
0.6804 | Remote Similarity | NPC8954 |
0.68 | Remote Similarity | NPC471599 |
0.6786 | Remote Similarity | NPC477085 |
0.6782 | Remote Similarity | NPC474005 |
0.6778 | Remote Similarity | NPC272814 |
0.6771 | Remote Similarity | NPC477722 |
0.6742 | Remote Similarity | NPC77003 |
0.6739 | Remote Similarity | NPC471368 |
0.6739 | Remote Similarity | NPC162071 |
0.6739 | Remote Similarity | NPC261253 |
0.6739 | Remote Similarity | NPC474045 |
0.6739 | Remote Similarity | NPC471369 |
0.6739 | Remote Similarity | NPC50637 |
0.6739 | Remote Similarity | NPC311163 |
0.6739 | Remote Similarity | NPC137253 |
0.6737 | Remote Similarity | NPC472126 |
0.6737 | Remote Similarity | NPC472125 |
0.6737 | Remote Similarity | NPC472124 |
0.6735 | Remote Similarity | NPC98112 |
0.6735 | Remote Similarity | NPC125551 |
0.6735 | Remote Similarity | NPC472188 |
0.6735 | Remote Similarity | NPC96597 |
0.6735 | Remote Similarity | NPC91197 |
0.6735 | Remote Similarity | NPC309503 |
0.6735 | Remote Similarity | NPC239547 |
0.6735 | Remote Similarity | NPC155319 |
0.6733 | Remote Similarity | NPC329704 |
0.6733 | Remote Similarity | NPC475928 |
0.6733 | Remote Similarity | NPC37240 |
0.6709 | Remote Similarity | NPC50435 |
0.6705 | Remote Similarity | NPC86971 |
0.6705 | Remote Similarity | NPC139712 |
0.6705 | Remote Similarity | NPC170561 |
0.6702 | Remote Similarity | NPC50464 |
0.6702 | Remote Similarity | NPC242877 |
0.6702 | Remote Similarity | NPC106040 |
0.6702 | Remote Similarity | NPC477748 |
0.6702 | Remote Similarity | NPC293044 |
0.6702 | Remote Similarity | NPC64913 |
0.6702 | Remote Similarity | NPC115179 |
0.6701 | Remote Similarity | NPC107476 |
0.6701 | Remote Similarity | NPC167893 |
0.6699 | Remote Similarity | NPC197813 |
0.6699 | Remote Similarity | NPC80338 |
0.6699 | Remote Similarity | NPC148270 |
0.6698 | Remote Similarity | NPC475924 |
0.6698 | Remote Similarity | NPC475851 |
0.6667 | Remote Similarity | NPC186109 |
0.6667 | Remote Similarity | NPC476800 |
0.6667 | Remote Similarity | NPC475703 |
0.6667 | Remote Similarity | NPC123880 |
0.6667 | Remote Similarity | NPC477086 |
0.6667 | Remote Similarity | NPC471225 |
0.6667 | Remote Similarity | NPC471159 |
0.6667 | Remote Similarity | NPC313658 |
0.6667 | Remote Similarity | NPC472195 |
0.6667 | Remote Similarity | NPC307846 |
0.6667 | Remote Similarity | NPC471056 |
0.6667 | Remote Similarity | NPC472196 |
0.6667 | Remote Similarity | NPC231889 |
0.6667 | Remote Similarity | NPC61201 |
0.6667 | Remote Similarity | NPC471055 |
0.6667 | Remote Similarity | NPC318917 |
0.6667 | Remote Similarity | NPC472186 |
0.6667 | Remote Similarity | NPC477087 |
0.6667 | Remote Similarity | NPC305157 |
0.6667 | Remote Similarity | NPC246860 |
0.6667 | Remote Similarity | NPC238090 |
0.6667 | Remote Similarity | NPC316138 |
0.6667 | Remote Similarity | NPC471366 |
0.6634 | Remote Similarity | NPC4899 |
0.6634 | Remote Similarity | NPC474730 |
0.6634 | Remote Similarity | NPC177013 |
0.6634 | Remote Similarity | NPC106668 |
0.6634 | Remote Similarity | NPC35185 |
0.6632 | Remote Similarity | NPC3952 |
0.6632 | Remote Similarity | NPC307699 |
0.663 | Remote Similarity | NPC67081 |
0.663 | Remote Similarity | NPC474369 |
0.663 | Remote Similarity | NPC471223 |
0.6629 | Remote Similarity | NPC233332 |
0.6628 | Remote Similarity | NPC474419 |
0.6627 | Remote Similarity | NPC329656 |
0.6627 | Remote Similarity | NPC101622 |
0.6602 | Remote Similarity | NPC170432 |
0.66 | Remote Similarity | NPC473204 |
0.66 | Remote Similarity | NPC130792 |
0.66 | Remote Similarity | NPC473545 |
0.66 | Remote Similarity | NPC472187 |
0.66 | Remote Similarity | NPC475053 |
0.6598 | Remote Similarity | NPC159698 |
0.6598 | Remote Similarity | NPC256368 |
0.6596 | Remote Similarity | NPC106332 |
0.6596 | Remote Similarity | NPC263079 |
0.6593 | Remote Similarity | NPC170286 |
0.6593 | Remote Similarity | NPC257358 |
0.6593 | Remote Similarity | NPC472440 |
0.6593 | Remote Similarity | NPC170377 |
0.6593 | Remote Similarity | NPC5958 |
0.6593 | Remote Similarity | NPC474472 |
0.6591 | Remote Similarity | NPC4436 |
0.6569 | Remote Similarity | NPC120009 |
0.6569 | Remote Similarity | NPC27687 |
0.6566 | Remote Similarity | NPC304445 |
0.6566 | Remote Similarity | NPC236580 |
0.6562 | Remote Similarity | NPC473150 |
0.6562 | Remote Similarity | NPC274274 |
0.6562 | Remote Similarity | NPC235051 |
0.6562 | Remote Similarity | NPC294643 |
0.6562 | Remote Similarity | NPC8729 |
0.6562 | Remote Similarity | NPC477749 |
0.6559 | Remote Similarity | NPC47220 |
0.6559 | Remote Similarity | NPC204048 |
0.6559 | Remote Similarity | NPC116575 |
0.6559 | Remote Similarity | NPC186332 |
0.6559 | Remote Similarity | NPC470242 |
0.6559 | Remote Similarity | NPC469676 |
0.6556 | Remote Similarity | NPC47635 |
0.6556 | Remote Similarity | NPC118116 |
0.6556 | Remote Similarity | NPC141810 |
0.6556 | Remote Similarity | NPC475481 |
0.6556 | Remote Similarity | NPC79277 |
0.6556 | Remote Similarity | NPC474894 |
0.6548 | Remote Similarity | NPC4299 |
0.6535 | Remote Similarity | NPC473332 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC475946 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 |
---|---|---|---|
0.675 | Remote Similarity | NPD2685 | Clinical (unspecified phase) |
0.6354 | Remote Similarity | NPD1695 | Approved |
0.6289 | Remote Similarity | NPD46 | Approved |
0.6289 | Remote Similarity | NPD7838 | Discovery |
0.6289 | Remote Similarity | NPD6698 | Approved |
0.6277 | Remote Similarity | NPD1733 | Clinical (unspecified phase) |
0.6275 | Remote Similarity | NPD6648 | Approved |
0.6214 | Remote Similarity | NPD5344 | Discontinued |
0.6176 | Remote Similarity | NPD8029 | Clinical (unspecified phase) |
0.617 | Remote Similarity | NPD6400 | Clinical (unspecified phase) |
0.6049 | Remote Similarity | NPD1145 | Discontinued |
0.6019 | Remote Similarity | NPD6686 | Approved |
0.596 | Remote Similarity | NPD3168 | Discontinued |
0.5948 | Remote Similarity | NPD7503 | Approved |
0.5876 | Remote Similarity | NPD4249 | Approved |
0.5859 | Remote Similarity | NPD6051 | Approved |
0.5856 | Remote Similarity | NPD8413 | Clinical (unspecified phase) |
0.5816 | Remote Similarity | NPD4251 | Approved |
0.5816 | Remote Similarity | NPD4250 | Approved |
0.5804 | Remote Similarity | NPD6053 | Discontinued |
0.5789 | Remote Similarity | NPD4752 | Clinical (unspecified phase) |
0.5752 | Remote Similarity | NPD8133 | Approved |
0.5729 | Remote Similarity | NPD7154 | Phase 3 |
0.5714 | Remote Similarity | NPD7638 | Approved |
0.569 | Remote Similarity | NPD7328 | Approved |
0.569 | Remote Similarity | NPD7327 | Approved |
0.5686 | Remote Similarity | NPD5778 | Approved |
0.5686 | Remote Similarity | NPD5779 | Approved |
0.5678 | Remote Similarity | NPD8513 | Phase 3 |
0.5678 | Remote Similarity | NPD8033 | Approved |
0.566 | Remote Similarity | NPD7639 | Approved |
0.566 | Remote Similarity | NPD7640 | Approved |
0.5641 | Remote Similarity | NPD7516 | Approved |
0.5631 | Remote Similarity | NPD5282 | Discontinued |
0.5625 | Remote Similarity | NPD5209 | Approved |
0.5612 | Remote Similarity | NPD6082 | Clinical (unspecified phase) |
PubChem CID   | |
ChEMBL   | CHEMBL519291 |
ZINC   |
Molecular Weight:   | 402.20 |
ALogP:   | 1.182 |
MLogP:   | 3.33 |
XLogP:   | 4.706 |
# Rotatable Bonds:   | 10 |
Polar Surface Area:   | 74.36 |
# H-Bond Aceptor:   | 6 |
# H-Bond Donor:   | 0 |
# Rings:   | 3 |
# Heavy Atoms:   | 29 |