Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT2 | Others | Unspecified | IC50 | > | 100000 | nM | 10.1007/s00044-011-9827-6 | |
NPT178 | Individual Protein | Protein-tyrosine phosphatase 1B | Homo sapiens | IC50 | = | 50020 | nM | 25871261 |
NPT1210 | Individual Protein | T-cell protein-tyrosine phosphatase | Homo sapiens | Inhibition | < | 50 | % | 12444694 |
NPT1870 | Individual Protein | Receptor-type tyrosine-protein phosphatase F (LAR) | Homo sapiens | Inhibition | < | 50 | % | 8676127 |
NPT206 | Individual Protein | Protein-tyrosine phosphatase 2C | Homo sapiens | Inhibition | < | 50 | % | PubChem BioAssay data set |
NPT205 | Individual Protein | Protein-tyrosine phosphatase 1C | Homo sapiens | Inhibition | < | 50 | % | 20547801 |
NPT911 | Individual Protein | Dual specificity phosphatase Cdc25B | Homo sapiens | Inhibition | < | 50 | % | 17850214 |
NPT81 | Cell Line | A549 | Homo sapiens | IC50 | > | 100000 | nM | DrugMatrix in vitro pharmacology data |
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 NPC96663 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 |
---|---|---|
0.8814 | High Similarity | NPC34883 |
0.8814 | High Similarity | NPC329698 |
0.85 | High Similarity | NPC226066 |
0.8387 | Intermediate Similarity | NPC472266 |
0.8269 | Intermediate Similarity | NPC197467 |
0.8125 | Intermediate Similarity | NPC269841 |
0.8125 | Intermediate Similarity | NPC101622 |
0.8077 | Intermediate Similarity | NPC47946 |
0.8077 | Intermediate Similarity | NPC26600 |
0.8 | Intermediate Similarity | NPC4299 |
0.8 | Intermediate Similarity | NPC19241 |
0.7937 | Intermediate Similarity | NPC185587 |
0.7879 | Intermediate Similarity | NPC477084 |
0.7879 | Intermediate Similarity | NPC472254 |
0.7818 | Intermediate Similarity | NPC289388 |
0.7742 | Intermediate Similarity | NPC155849 |
0.7742 | Intermediate Similarity | NPC217940 |
0.7727 | Intermediate Similarity | NPC64234 |
0.7727 | Intermediate Similarity | NPC37929 |
0.7727 | Intermediate Similarity | NPC469660 |
0.7692 | Intermediate Similarity | NPC276290 |
0.7679 | Intermediate Similarity | NPC244452 |
0.7636 | Intermediate Similarity | NPC135698 |
0.7612 | Intermediate Similarity | NPC257618 |
0.7593 | Intermediate Similarity | NPC128280 |
0.7586 | Intermediate Similarity | NPC269615 |
0.7576 | Intermediate Similarity | NPC232812 |
0.7544 | Intermediate Similarity | NPC106531 |
0.7544 | Intermediate Similarity | NPC170167 |
0.75 | Intermediate Similarity | NPC471279 |
0.75 | Intermediate Similarity | NPC477085 |
0.75 | Intermediate Similarity | NPC26960 |
0.75 | Intermediate Similarity | NPC476489 |
0.75 | Intermediate Similarity | NPC476490 |
0.75 | Intermediate Similarity | NPC222244 |
0.75 | Intermediate Similarity | NPC16349 |
0.75 | Intermediate Similarity | NPC471277 |
0.75 | Intermediate Similarity | NPC142103 |
0.75 | Intermediate Similarity | NPC135703 |
0.75 | Intermediate Similarity | NPC182102 |
0.75 | Intermediate Similarity | NPC236338 |
0.7463 | Intermediate Similarity | NPC473361 |
0.7463 | Intermediate Similarity | NPC329904 |
0.7429 | Intermediate Similarity | NPC469880 |
0.7429 | Intermediate Similarity | NPC301525 |
0.7419 | Intermediate Similarity | NPC127824 |
0.7407 | Intermediate Similarity | NPC270706 |
0.7391 | Intermediate Similarity | NPC474758 |
0.7385 | Intermediate Similarity | NPC191233 |
0.7368 | Intermediate Similarity | NPC148056 |
0.7353 | Intermediate Similarity | NPC477087 |
0.7353 | Intermediate Similarity | NPC477086 |
0.7353 | Intermediate Similarity | NPC181587 |
0.7324 | Intermediate Similarity | NPC84360 |
0.7324 | Intermediate Similarity | NPC476439 |
0.7321 | Intermediate Similarity | NPC15912 |
0.7313 | Intermediate Similarity | NPC265574 |
0.7313 | Intermediate Similarity | NPC151481 |
0.7286 | Intermediate Similarity | NPC228978 |
0.7273 | Intermediate Similarity | NPC194871 |
0.7258 | Intermediate Similarity | NPC143810 |
0.7258 | Intermediate Similarity | NPC83838 |
0.7241 | Intermediate Similarity | NPC151919 |
0.7231 | Intermediate Similarity | NPC220766 |
0.7231 | Intermediate Similarity | NPC470688 |
0.7222 | Intermediate Similarity | NPC474005 |
0.7222 | Intermediate Similarity | NPC12907 |
0.7213 | Intermediate Similarity | NPC129150 |
0.7213 | Intermediate Similarity | NPC294938 |
0.7213 | Intermediate Similarity | NPC249850 |
0.7213 | Intermediate Similarity | NPC293437 |
0.7193 | Intermediate Similarity | NPC27264 |
0.7188 | Intermediate Similarity | NPC44343 |
0.7188 | Intermediate Similarity | NPC179087 |
0.7188 | Intermediate Similarity | NPC210303 |
0.7183 | Intermediate Similarity | NPC27205 |
0.7183 | Intermediate Similarity | NPC4509 |
0.7183 | Intermediate Similarity | NPC476317 |
0.717 | Intermediate Similarity | NPC57923 |
0.7164 | Intermediate Similarity | NPC470256 |
0.7143 | Intermediate Similarity | NPC259599 |
0.7143 | Intermediate Similarity | NPC299730 |
0.7143 | Intermediate Similarity | NPC477204 |
0.7143 | Intermediate Similarity | NPC117746 |
0.7143 | Intermediate Similarity | NPC471278 |
0.7143 | Intermediate Similarity | NPC140287 |
0.7143 | Intermediate Similarity | NPC474551 |
0.7143 | Intermediate Similarity | NPC15499 |
0.7143 | Intermediate Similarity | NPC294434 |
0.7123 | Intermediate Similarity | NPC477088 |
0.7123 | Intermediate Similarity | NPC242767 |
0.7123 | Intermediate Similarity | NPC471537 |
0.7123 | Intermediate Similarity | NPC325869 |
0.7101 | Intermediate Similarity | NPC129665 |
0.7101 | Intermediate Similarity | NPC163003 |
0.7097 | Intermediate Similarity | NPC254095 |
0.7097 | Intermediate Similarity | NPC21946 |
0.7097 | Intermediate Similarity | NPC223679 |
0.7083 | Intermediate Similarity | NPC262747 |
0.7083 | Intermediate Similarity | NPC473756 |
0.7077 | Intermediate Similarity | NPC469723 |
0.7059 | Intermediate Similarity | NPC329656 |
0.7059 | Intermediate Similarity | NPC470693 |
0.7059 | Intermediate Similarity | NPC22301 |
0.7049 | Intermediate Similarity | NPC141699 |
0.7042 | Intermediate Similarity | NPC244166 |
0.7042 | Intermediate Similarity | NPC65650 |
0.7042 | Intermediate Similarity | NPC329852 |
0.7031 | Intermediate Similarity | NPC55376 |
0.7027 | Intermediate Similarity | NPC472470 |
0.7027 | Intermediate Similarity | NPC469802 |
0.7027 | Intermediate Similarity | NPC474739 |
0.7027 | Intermediate Similarity | NPC233332 |
0.7018 | Intermediate Similarity | NPC207815 |
0.7018 | Intermediate Similarity | NPC234597 |
0.7 | Intermediate Similarity | NPC472018 |
0.7 | Intermediate Similarity | NPC474543 |
0.7 | Intermediate Similarity | NPC478120 |
0.7 | Intermediate Similarity | NPC238425 |
0.6986 | Remote Similarity | NPC474341 |
0.6986 | Remote Similarity | NPC128276 |
0.6986 | Remote Similarity | NPC471220 |
0.6986 | Remote Similarity | NPC209135 |
0.6986 | Remote Similarity | NPC474816 |
0.6984 | Remote Similarity | NPC474267 |
0.6984 | Remote Similarity | NPC82465 |
0.6984 | Remote Similarity | NPC286189 |
0.697 | Remote Similarity | NPC107258 |
0.6957 | Remote Similarity | NPC475310 |
0.6957 | Remote Similarity | NPC316029 |
0.6949 | Remote Similarity | NPC216407 |
0.6944 | Remote Similarity | NPC477202 |
0.6944 | Remote Similarity | NPC235906 |
0.6935 | Remote Similarity | NPC212730 |
0.6935 | Remote Similarity | NPC265551 |
0.6935 | Remote Similarity | NPC165808 |
0.6935 | Remote Similarity | NPC135863 |
0.6933 | Remote Similarity | NPC79277 |
0.6933 | Remote Similarity | NPC25554 |
0.6933 | Remote Similarity | NPC471325 |
0.6933 | Remote Similarity | NPC14203 |
0.6933 | Remote Similarity | NPC474894 |
0.6933 | Remote Similarity | NPC112868 |
0.6933 | Remote Similarity | NPC229584 |
0.6933 | Remote Similarity | NPC475481 |
0.6912 | Remote Similarity | NPC310210 |
0.6901 | Remote Similarity | NPC470686 |
0.6901 | Remote Similarity | NPC476355 |
0.6901 | Remote Similarity | NPC20025 |
0.6897 | Remote Similarity | NPC15789 |
0.6892 | Remote Similarity | NPC471299 |
0.6892 | Remote Similarity | NPC139712 |
0.6892 | Remote Similarity | NPC469690 |
0.6892 | Remote Similarity | NPC86971 |
0.6885 | Remote Similarity | NPC223604 |
0.6885 | Remote Similarity | NPC477984 |
0.6885 | Remote Similarity | NPC478117 |
0.6875 | Remote Similarity | NPC79756 |
0.6866 | Remote Similarity | NPC259156 |
0.6866 | Remote Similarity | NPC242945 |
0.6857 | Remote Similarity | NPC316185 |
0.6849 | Remote Similarity | NPC97516 |
0.6849 | Remote Similarity | NPC57744 |
0.6849 | Remote Similarity | NPC65603 |
0.6849 | Remote Similarity | NPC40049 |
0.6849 | Remote Similarity | NPC474760 |
0.6849 | Remote Similarity | NPC41780 |
0.6849 | Remote Similarity | NPC477203 |
0.6849 | Remote Similarity | NPC315394 |
0.6849 | Remote Similarity | NPC470240 |
0.6849 | Remote Similarity | NPC187568 |
0.6849 | Remote Similarity | NPC476794 |
0.6842 | Remote Similarity | NPC35556 |
0.6842 | Remote Similarity | NPC471218 |
0.6812 | Remote Similarity | NPC107130 |
0.6806 | Remote Similarity | NPC193351 |
0.6806 | Remote Similarity | NPC138408 |
0.6806 | Remote Similarity | NPC155587 |
0.6806 | Remote Similarity | NPC226669 |
0.6774 | Remote Similarity | NPC252860 |
0.6769 | Remote Similarity | NPC317025 |
0.6769 | Remote Similarity | NPC317177 |
0.6769 | Remote Similarity | NPC326645 |
0.6769 | Remote Similarity | NPC329416 |
0.6765 | Remote Similarity | NPC21998 |
0.6765 | Remote Similarity | NPC225272 |
0.6761 | Remote Similarity | NPC58956 |
0.6761 | Remote Similarity | NPC470237 |
0.6761 | Remote Similarity | NPC269206 |
0.6761 | Remote Similarity | NPC295633 |
0.6761 | Remote Similarity | NPC276336 |
0.6757 | Remote Similarity | NPC105197 |
0.6757 | Remote Similarity | NPC253749 |
0.6757 | Remote Similarity | NPC299235 |
0.6757 | Remote Similarity | NPC184737 |
0.6753 | Remote Similarity | NPC42476 |
0.6753 | Remote Similarity | NPC472473 |
0.6753 | Remote Similarity | NPC475947 |
0.6753 | Remote Similarity | NPC170377 |
0.6753 | Remote Similarity | NPC469 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC96663 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 |
---|---|---|---|
0.85 | High Similarity | NPD5325 | Clinical (unspecified phase) |
0.8065 | Intermediate Similarity | NPD2685 | Clinical (unspecified phase) |
0.8 | Intermediate Similarity | NPD6927 | Phase 3 |
0.7286 | Intermediate Similarity | NPD8039 | Approved |
0.6769 | Remote Similarity | NPD4192 | Approved |
0.6769 | Remote Similarity | NPD4191 | Approved |
0.6769 | Remote Similarity | NPD4193 | Approved |
0.6769 | Remote Similarity | NPD4194 | Approved |
0.6623 | Remote Similarity | NPD4752 | Clinical (unspecified phase) |
0.6607 | Remote Similarity | NPD6097 | Approved |
0.6607 | Remote Similarity | NPD6096 | Approved |
0.6582 | Remote Similarity | NPD6082 | Clinical (unspecified phase) |
0.6552 | Remote Similarity | NPD5343 | Approved |
0.6456 | Remote Similarity | NPD6400 | Clinical (unspecified phase) |
0.641 | Remote Similarity | NPD5209 | Approved |
0.6329 | Remote Similarity | NPD7154 | Phase 3 |
0.6265 | Remote Similarity | NPD6051 | Approved |
0.625 | Remote Similarity | NPD4219 | Approved |
0.619 | Remote Similarity | NPD6698 | Approved |
0.619 | Remote Similarity | NPD46 | Approved |
0.619 | Remote Similarity | NPD7838 | Discovery |
0.6167 | Remote Similarity | NPD4220 | Pre-registration |
0.6154 | Remote Similarity | NPD5790 | Clinical (unspecified phase) |
0.6125 | Remote Similarity | NPD5362 | Discontinued |
0.6104 | Remote Similarity | NPD5784 | Clinical (unspecified phase) |
0.6066 | Remote Similarity | NPD2268 | Discontinued |
0.5976 | Remote Similarity | NPD1694 | Approved |
0.5976 | Remote Similarity | NPD1733 | Clinical (unspecified phase) |
0.5968 | Remote Similarity | NPD28 | Approved |
0.5968 | Remote Similarity | NPD29 | Approved |
0.5949 | Remote Similarity | NPD4822 | Approved |
0.5949 | Remote Similarity | NPD4820 | Approved |
0.5949 | Remote Similarity | NPD4819 | Approved |
0.5949 | Remote Similarity | NPD4821 | Approved |
0.5932 | Remote Similarity | NPD4265 | Approved |
0.5932 | Remote Similarity | NPD39 | Approved |
0.5926 | Remote Similarity | NPD5332 | Approved |
0.5926 | Remote Similarity | NPD5331 | Approved |
0.5897 | Remote Similarity | NPD4271 | Approved |
0.5897 | Remote Similarity | NPD4268 | Approved |
0.5882 | Remote Similarity | NPD4246 | Clinical (unspecified phase) |
0.5875 | Remote Similarity | NPD4790 | Discontinued |
0.5846 | Remote Similarity | NPD342 | Phase 1 |
0.5814 | Remote Similarity | NPD5785 | Approved |
0.5802 | Remote Similarity | NPD4270 | Approved |
0.5802 | Remote Similarity | NPD6435 | Approved |
0.5802 | Remote Similarity | NPD4269 | Approved |
0.5797 | Remote Similarity | NPD368 | Approved |
0.575 | Remote Similarity | NPD4252 | Approved |
0.5747 | Remote Similarity | NPD7637 | Suspended |
0.5747 | Remote Similarity | NPD7983 | Approved |
0.5714 | Remote Similarity | NPD7638 | Approved |
0.5714 | Remote Similarity | NPD7146 | Approved |
0.5714 | Remote Similarity | NPD5783 | Phase 3 |
0.5714 | Remote Similarity | NPD7334 | Approved |
0.5714 | Remote Similarity | NPD8029 | Clinical (unspecified phase) |
0.5714 | Remote Similarity | NPD5330 | Approved |
0.5714 | Remote Similarity | NPD6684 | Approved |
0.5714 | Remote Similarity | NPD7521 | Approved |
0.5714 | Remote Similarity | NPD6409 | Approved |
0.5714 | Remote Similarity | NPD5786 | Approved |
0.5698 | Remote Similarity | NPD1695 | Approved |
0.5692 | Remote Similarity | NPD4266 | Approved |
0.5692 | Remote Similarity | NPD3194 | Approved |
0.5692 | Remote Similarity | NPD3196 | Approved |
0.5692 | Remote Similarity | NPD3195 | Phase 2 |
0.5682 | Remote Similarity | NPD5778 | Approved |
0.5682 | Remote Similarity | NPD5779 | Approved |
0.5679 | Remote Similarity | NPD5369 | Approved |
0.5667 | Remote Similarity | NPD3174 | Discontinued |
0.5652 | Remote Similarity | NPD6648 | Approved |
0.5652 | Remote Similarity | NPD7639 | Approved |
0.5652 | Remote Similarity | NPD7640 | Approved |
0.5647 | Remote Similarity | NPD4250 | Approved |
0.5647 | Remote Similarity | NPD4251 | Approved |
0.5636 | Remote Similarity | NPD319 | Phase 1 |
PubChem CID   | 637195 |
ChEMBL   | CHEMBL3356397 |
ZINC   |
Molecular Weight:   | 338.32 |
ALogP:   | 2.1607 |
MLogP:   | 3.66 |
XLogP:   | 9.689 |
# Rotatable Bonds:   | 21 |
Polar Surface Area:   | 26.3 |
# H-Bond Aceptor:   | 2 |
# H-Bond Donor:   | 0 |
# Rings:   | 0 |
# Heavy Atoms:   | 24 |