Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT591 | Individual Protein | Glycogen synthase kinase-3 beta | Homo sapiens | Inhibition | = | 2.9 | % | 17566732 |
NPT2 | Others | Unspecified | Potency | 61.6 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 27535.7 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 27306 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 54941 | nM | PubChem BioAssay data set |
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 NPC280532 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 |
---|---|---|
0.931 | High Similarity | NPC151140 |
0.931 | High Similarity | NPC104195 |
0.931 | High Similarity | NPC61066 |
0.931 | High Similarity | NPC122768 |
0.8276 | Intermediate Similarity | NPC230726 |
0.8276 | Intermediate Similarity | NPC149209 |
0.8182 | Intermediate Similarity | NPC307027 |
0.8065 | Intermediate Similarity | NPC174368 |
0.8056 | Intermediate Similarity | NPC3531 |
0.8 | Intermediate Similarity | NPC252843 |
0.7941 | Intermediate Similarity | NPC316685 |
0.7778 | Intermediate Similarity | NPC38930 |
0.7778 | Intermediate Similarity | NPC325454 |
0.7667 | Intermediate Similarity | NPC314668 |
0.7632 | Intermediate Similarity | NPC248763 |
0.7632 | Intermediate Similarity | NPC325452 |
0.7368 | Intermediate Similarity | NPC240109 |
0.7353 | Intermediate Similarity | NPC175342 |
0.7273 | Intermediate Similarity | NPC21374 |
0.7143 | Intermediate Similarity | NPC7814 |
0.7143 | Intermediate Similarity | NPC127142 |
0.7105 | Intermediate Similarity | NPC222792 |
0.7105 | Intermediate Similarity | NPC316217 |
0.7 | Intermediate Similarity | NPC310220 |
0.697 | Remote Similarity | NPC292641 |
0.6905 | Remote Similarity | NPC314679 |
0.6897 | Remote Similarity | NPC181153 |
0.6857 | Remote Similarity | NPC18224 |
0.6857 | Remote Similarity | NPC35371 |
0.6857 | Remote Similarity | NPC125575 |
0.6857 | Remote Similarity | NPC94196 |
0.6857 | Remote Similarity | NPC168714 |
0.6857 | Remote Similarity | NPC178643 |
0.6857 | Remote Similarity | NPC328710 |
0.6857 | Remote Similarity | NPC41007 |
0.6829 | Remote Similarity | NPC319680 |
0.6774 | Remote Similarity | NPC227197 |
0.6774 | Remote Similarity | NPC28246 |
0.6765 | Remote Similarity | NPC241404 |
0.6765 | Remote Similarity | NPC198126 |
0.6765 | Remote Similarity | NPC320981 |
0.6757 | Remote Similarity | NPC155263 |
0.6667 | Remote Similarity | NPC236709 |
0.6667 | Remote Similarity | NPC55023 |
0.6667 | Remote Similarity | NPC281943 |
0.6667 | Remote Similarity | NPC317739 |
0.6591 | Remote Similarity | NPC477878 |
0.6591 | Remote Similarity | NPC324793 |
0.6579 | Remote Similarity | NPC14608 |
0.6579 | Remote Similarity | NPC109026 |
0.6579 | Remote Similarity | NPC158179 |
0.6579 | Remote Similarity | NPC206924 |
0.6571 | Remote Similarity | NPC212144 |
0.6571 | Remote Similarity | NPC328569 |
0.6562 | Remote Similarity | NPC211250 |
0.6512 | Remote Similarity | NPC133771 |
0.6486 | Remote Similarity | NPC168052 |
0.6486 | Remote Similarity | NPC191084 |
0.6486 | Remote Similarity | NPC250870 |
0.6486 | Remote Similarity | NPC317203 |
0.6444 | Remote Similarity | NPC226027 |
0.6444 | Remote Similarity | NPC84636 |
0.6444 | Remote Similarity | NPC43204 |
0.6444 | Remote Similarity | NPC174246 |
0.6429 | Remote Similarity | NPC325097 |
0.6429 | Remote Similarity | NPC132307 |
0.6429 | Remote Similarity | NPC126925 |
0.641 | Remote Similarity | NPC73245 |
0.6364 | Remote Similarity | NPC143211 |
0.6364 | Remote Similarity | NPC21844 |
0.6316 | Remote Similarity | NPC134782 |
0.6316 | Remote Similarity | NPC5505 |
0.625 | Remote Similarity | NPC301696 |
0.625 | Remote Similarity | NPC14227 |
0.625 | Remote Similarity | NPC279026 |
0.625 | Remote Similarity | NPC301585 |
0.625 | Remote Similarity | NPC201844 |
0.625 | Remote Similarity | NPC261080 |
0.625 | Remote Similarity | NPC113928 |
0.625 | Remote Similarity | NPC154186 |
0.625 | Remote Similarity | NPC307594 |
0.6154 | Remote Similarity | NPC317945 |
0.6129 | Remote Similarity | NPC8187 |
0.6129 | Remote Similarity | NPC203105 |
0.6111 | Remote Similarity | NPC12904 |
0.6087 | Remote Similarity | NPC245027 |
0.6087 | Remote Similarity | NPC162620 |
0.6087 | Remote Similarity | NPC62045 |
0.6061 | Remote Similarity | NPC166804 |
0.6061 | Remote Similarity | NPC201132 |
0.6061 | Remote Similarity | NPC286233 |
0.6053 | Remote Similarity | NPC155872 |
0.6 | Remote Similarity | NPC268826 |
0.6 | Remote Similarity | NPC248139 |
0.6 | Remote Similarity | NPC180423 |
0.6 | Remote Similarity | NPC316546 |
0.6 | Remote Similarity | NPC127696 |
0.5952 | Remote Similarity | NPC103286 |
0.5952 | Remote Similarity | NPC171736 |
0.5952 | Remote Similarity | NPC209970 |
0.5952 | Remote Similarity | NPC307783 |
0.5952 | Remote Similarity | NPC216630 |
0.5952 | Remote Similarity | NPC196924 |
0.5952 | Remote Similarity | NPC163746 |
0.5952 | Remote Similarity | NPC149184 |
0.5946 | Remote Similarity | NPC14778 |
0.5946 | Remote Similarity | NPC286695 |
0.5938 | Remote Similarity | NPC23071 |
0.5938 | Remote Similarity | NPC91093 |
0.5938 | Remote Similarity | NPC256186 |
0.5918 | Remote Similarity | NPC72722 |
0.5897 | Remote Similarity | NPC9294 |
0.5882 | Remote Similarity | NPC276332 |
0.5882 | Remote Similarity | NPC39869 |
0.5882 | Remote Similarity | NPC248233 |
0.5882 | Remote Similarity | NPC100997 |
0.5862 | Remote Similarity | NPC68873 |
0.5854 | Remote Similarity | NPC81263 |
0.5854 | Remote Similarity | NPC118968 |
0.5854 | Remote Similarity | NPC183424 |
0.5854 | Remote Similarity | NPC214610 |
0.5854 | Remote Similarity | NPC294085 |
0.5854 | Remote Similarity | NPC329545 |
0.5833 | Remote Similarity | NPC302611 |
0.5833 | Remote Similarity | NPC16947 |
0.5833 | Remote Similarity | NPC322946 |
0.5833 | Remote Similarity | NPC48162 |
0.5814 | Remote Similarity | NPC67462 |
0.5814 | Remote Similarity | NPC71317 |
0.5814 | Remote Similarity | NPC129972 |
0.5814 | Remote Similarity | NPC289686 |
0.5814 | Remote Similarity | NPC301528 |
0.5806 | Remote Similarity | NPC222945 |
0.5806 | Remote Similarity | NPC83723 |
0.5789 | Remote Similarity | NPC248190 |
0.5789 | Remote Similarity | NPC57499 |
0.5789 | Remote Similarity | NPC217161 |
0.5789 | Remote Similarity | NPC154396 |
0.5778 | Remote Similarity | NPC282440 |
0.5778 | Remote Similarity | NPC308301 |
0.5758 | Remote Similarity | NPC41485 |
0.5758 | Remote Similarity | NPC32280 |
0.5758 | Remote Similarity | NPC304927 |
0.5758 | Remote Similarity | NPC289974 |
0.5758 | Remote Similarity | NPC3693 |
0.5745 | Remote Similarity | NPC328378 |
0.5745 | Remote Similarity | NPC293378 |
0.5745 | Remote Similarity | NPC476469 |
0.5714 | Remote Similarity | NPC317680 |
0.5714 | Remote Similarity | NPC287782 |
0.5714 | Remote Similarity | NPC168375 |
0.5714 | Remote Similarity | NPC326992 |
0.5714 | Remote Similarity | NPC66043 |
0.5714 | Remote Similarity | NPC121517 |
0.5686 | Remote Similarity | NPC67367 |
0.5682 | Remote Similarity | NPC255837 |
0.5682 | Remote Similarity | NPC74845 |
0.5682 | Remote Similarity | NPC19305 |
0.5676 | Remote Similarity | NPC228727 |
0.5641 | Remote Similarity | NPC121215 |
0.5641 | Remote Similarity | NPC156630 |
0.5625 | Remote Similarity | NPC185768 |
0.5625 | Remote Similarity | NPC33928 |
0.561 | Remote Similarity | NPC128713 |
0.561 | Remote Similarity | NPC18188 |
0.56 | Remote Similarity | NPC19676 |
0.56 | Remote Similarity | NPC323401 |
0.56 | Remote Similarity | NPC65985 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC280532 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 | NPD77 | Approved |
0.8056 | Intermediate Similarity | NPD9450 | Approved |
0.7838 | Intermediate Similarity | NPD9635 | Discontinued |
0.7429 | Intermediate Similarity | NPD9447 | Approved |
0.7419 | Intermediate Similarity | NPD8990 | Clinical (unspecified phase) |
0.7143 | Intermediate Similarity | NPD8857 | Approved |
0.7027 | Intermediate Similarity | NPD9449 | Clinical (unspecified phase) |
0.6905 | Remote Similarity | NPD634 | Phase 3 |
0.6897 | Remote Similarity | NPD8201 | Phase 2 |
0.6897 | Remote Similarity | NPD8615 | Phase 2 |
0.6897 | Remote Similarity | NPD8616 | Clinical (unspecified phase) |
0.6765 | Remote Similarity | NPD8590 | Approved |
0.6765 | Remote Similarity | NPD8618 | Approved |
0.6667 | Remote Similarity | NPD8593 | Approved |
0.6667 | Remote Similarity | NPD8594 | Approved |
0.6471 | Remote Similarity | NPD8619 | Approved |
0.6471 | Remote Similarity | NPD8617 | Approved |
0.6444 | Remote Similarity | NPD9017 | Approved |
0.6429 | Remote Similarity | NPD8975 | Clinical (unspecified phase) |
0.6429 | Remote Similarity | NPD8798 | Approved |
0.6341 | Remote Similarity | NPD9116 | Phase 1 |
0.6279 | Remote Similarity | NPD8974 | Clinical (unspecified phase) |
0.625 | Remote Similarity | NPD633 | Phase 3 |
0.625 | Remote Similarity | NPD9448 | Phase 2 |
0.6087 | Remote Similarity | NPD9018 | Approved |
0.6061 | Remote Similarity | NPD8189 | Approved |
0.6042 | Remote Similarity | NPD3186 | Phase 1 |
0.6 | Remote Similarity | NPD62 | Approved |
0.5952 | Remote Similarity | NPD2270 | Approved |
0.5882 | Remote Similarity | NPD106 | Approved |
0.587 | Remote Similarity | NPD2266 | Phase 2 |
0.5862 | Remote Similarity | NPD7364 | Approved |
0.5862 | Remote Similarity | NPD8200 | Phase 2 |
0.5854 | Remote Similarity | NPD9655 | Approved |
0.5833 | Remote Similarity | NPD9441 | Phase 2 |
0.58 | Remote Similarity | NPD615 | Clinical (unspecified phase) |
0.5778 | Remote Similarity | NPD8801 | Approved |
0.5758 | Remote Similarity | NPD8591 | Approved |
0.5758 | Remote Similarity | NPD8592 | Approved |
0.5745 | Remote Similarity | NPD9129 | Approved |
0.5745 | Remote Similarity | NPD8947 | Approved |
0.5745 | Remote Similarity | NPD71 | Approved |
0.5745 | Remote Similarity | NPD9126 | Approved |
0.5745 | Remote Similarity | NPD8946 | Approved |
0.5686 | Remote Similarity | NPD9454 | Approved |
0.5682 | Remote Similarity | NPD9411 | Phase 1 |
0.5652 | Remote Similarity | NPD8850 | Approved |
0.5641 | Remote Similarity | NPD8596 | Approved |
0.561 | Remote Similarity | NPD8623 | Phase 1 |
PubChem CID   | 6915 |
ChEMBL   | CHEMBL184290 |
ZINC   |
Molecular Weight:   | 116.08 |
ALogP:   | -0.8579 |
MLogP:   | 1.9 |
XLogP:   | 1.604 |
# Rotatable Bonds:   | 6 |
Polar Surface Area:   | 37.3 |
# H-Bond Aceptor:   | 2 |
# H-Bond Donor:   | 1 |
# Rings:   | 0 |
# Heavy Atoms:   | 8 |