Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT393 | Cell Line | HCT-116 | Homo sapiens | IC50 | > | 50 | ug/ml | 15568791 |
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 NPC84038 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 |
---|---|---|
0.9851 | High Similarity | NPC474705 |
0.9254 | High Similarity | NPC218477 |
0.8857 | High Similarity | NPC186531 |
0.875 | High Similarity | NPC469414 |
0.875 | High Similarity | NPC329826 |
0.8676 | High Similarity | NPC248125 |
0.863 | High Similarity | NPC123360 |
0.8442 | Intermediate Similarity | NPC475159 |
0.8442 | Intermediate Similarity | NPC329829 |
0.8442 | Intermediate Similarity | NPC473529 |
0.8442 | Intermediate Similarity | NPC180363 |
0.8442 | Intermediate Similarity | NPC131002 |
0.8442 | Intermediate Similarity | NPC65930 |
0.8442 | Intermediate Similarity | NPC11332 |
0.8442 | Intermediate Similarity | NPC73310 |
0.8442 | Intermediate Similarity | NPC473712 |
0.8442 | Intermediate Similarity | NPC473780 |
0.8442 | Intermediate Similarity | NPC94875 |
0.8442 | Intermediate Similarity | NPC145914 |
0.84 | Intermediate Similarity | NPC128276 |
0.8356 | Intermediate Similarity | NPC140287 |
0.8356 | Intermediate Similarity | NPC476355 |
0.8333 | Intermediate Similarity | NPC475947 |
0.8333 | Intermediate Similarity | NPC253801 |
0.8333 | Intermediate Similarity | NPC144415 |
0.8312 | Intermediate Similarity | NPC471325 |
0.8286 | Intermediate Similarity | NPC203335 |
0.8267 | Intermediate Similarity | NPC57744 |
0.8228 | Intermediate Similarity | NPC156804 |
0.8228 | Intermediate Similarity | NPC163093 |
0.8219 | Intermediate Similarity | NPC144419 |
0.8205 | Intermediate Similarity | NPC173609 |
0.8125 | Intermediate Similarity | NPC25764 |
0.8125 | Intermediate Similarity | NPC120398 |
0.8125 | Intermediate Similarity | NPC283085 |
0.8125 | Intermediate Similarity | NPC39279 |
0.8125 | Intermediate Similarity | NPC110710 |
0.8125 | Intermediate Similarity | NPC9678 |
0.8125 | Intermediate Similarity | NPC319036 |
0.8125 | Intermediate Similarity | NPC82795 |
0.8125 | Intermediate Similarity | NPC322529 |
0.8125 | Intermediate Similarity | NPC329838 |
0.8125 | Intermediate Similarity | NPC470400 |
0.8125 | Intermediate Similarity | NPC292809 |
0.8125 | Intermediate Similarity | NPC475268 |
0.8125 | Intermediate Similarity | NPC477018 |
0.8125 | Intermediate Similarity | NPC66346 |
0.8125 | Intermediate Similarity | NPC329615 |
0.8125 | Intermediate Similarity | NPC471567 |
0.8125 | Intermediate Similarity | NPC473651 |
0.8125 | Intermediate Similarity | NPC477013 |
0.8125 | Intermediate Similarity | NPC107986 |
0.8125 | Intermediate Similarity | NPC103284 |
0.8125 | Intermediate Similarity | NPC202055 |
0.8125 | Intermediate Similarity | NPC132496 |
0.8125 | Intermediate Similarity | NPC1083 |
0.8125 | Intermediate Similarity | NPC223871 |
0.8125 | Intermediate Similarity | NPC473478 |
0.8125 | Intermediate Similarity | NPC286338 |
0.8125 | Intermediate Similarity | NPC473156 |
0.8125 | Intermediate Similarity | NPC473669 |
0.8125 | Intermediate Similarity | NPC100921 |
0.8125 | Intermediate Similarity | NPC231009 |
0.8125 | Intermediate Similarity | NPC473671 |
0.8125 | Intermediate Similarity | NPC39167 |
0.8125 | Intermediate Similarity | NPC235809 |
0.8125 | Intermediate Similarity | NPC477014 |
0.8125 | Intermediate Similarity | NPC77871 |
0.8108 | Intermediate Similarity | NPC474758 |
0.8088 | Intermediate Similarity | NPC151648 |
0.8082 | Intermediate Similarity | NPC163003 |
0.8052 | Intermediate Similarity | NPC178277 |
0.8028 | Intermediate Similarity | NPC472266 |
0.8026 | Intermediate Similarity | NPC68156 |
0.8026 | Intermediate Similarity | NPC97516 |
0.8026 | Intermediate Similarity | NPC10572 |
0.8025 | Intermediate Similarity | NPC477010 |
0.8025 | Intermediate Similarity | NPC210218 |
0.8025 | Intermediate Similarity | NPC282815 |
0.8025 | Intermediate Similarity | NPC232555 |
0.8025 | Intermediate Similarity | NPC107717 |
0.8025 | Intermediate Similarity | NPC62118 |
0.8025 | Intermediate Similarity | NPC103523 |
0.8025 | Intermediate Similarity | NPC204686 |
0.8025 | Intermediate Similarity | NPC134807 |
0.8025 | Intermediate Similarity | NPC231096 |
0.8025 | Intermediate Similarity | NPC241360 |
0.8025 | Intermediate Similarity | NPC112685 |
0.8025 | Intermediate Similarity | NPC473840 |
0.8025 | Intermediate Similarity | NPC219498 |
0.8025 | Intermediate Similarity | NPC134885 |
0.8025 | Intermediate Similarity | NPC475581 |
0.8025 | Intermediate Similarity | NPC134865 |
0.8025 | Intermediate Similarity | NPC142117 |
0.8025 | Intermediate Similarity | NPC477015 |
0.8025 | Intermediate Similarity | NPC171174 |
0.8025 | Intermediate Similarity | NPC240695 |
0.8025 | Intermediate Similarity | NPC279267 |
0.8025 | Intermediate Similarity | NPC132940 |
0.8025 | Intermediate Similarity | NPC308412 |
0.8025 | Intermediate Similarity | NPC473687 |
0.8025 | Intermediate Similarity | NPC69082 |
0.8025 | Intermediate Similarity | NPC25703 |
0.8025 | Intermediate Similarity | NPC114694 |
0.8025 | Intermediate Similarity | NPC219652 |
0.8025 | Intermediate Similarity | NPC309211 |
0.8025 | Intermediate Similarity | NPC293136 |
0.7975 | Intermediate Similarity | NPC35556 |
0.7945 | Intermediate Similarity | NPC469660 |
0.7945 | Intermediate Similarity | NPC67183 |
0.7941 | Intermediate Similarity | NPC143857 |
0.7941 | Intermediate Similarity | NPC229252 |
0.7927 | Intermediate Similarity | NPC20533 |
0.7927 | Intermediate Similarity | NPC258068 |
0.7927 | Intermediate Similarity | NPC473995 |
0.7927 | Intermediate Similarity | NPC470401 |
0.7927 | Intermediate Similarity | NPC178215 |
0.7927 | Intermediate Similarity | NPC154097 |
0.7927 | Intermediate Similarity | NPC473649 |
0.7927 | Intermediate Similarity | NPC476583 |
0.7927 | Intermediate Similarity | NPC159750 |
0.7927 | Intermediate Similarity | NPC477012 |
0.7922 | Intermediate Similarity | NPC299235 |
0.7922 | Intermediate Similarity | NPC93763 |
0.7922 | Intermediate Similarity | NPC108816 |
0.7901 | Intermediate Similarity | NPC182383 |
0.7895 | Intermediate Similarity | NPC27205 |
0.7867 | Intermediate Similarity | NPC117746 |
0.7867 | Intermediate Similarity | NPC294434 |
0.7867 | Intermediate Similarity | NPC15499 |
0.7867 | Intermediate Similarity | NPC259599 |
0.7848 | Intermediate Similarity | NPC42470 |
0.7831 | Intermediate Similarity | NPC320569 |
0.7831 | Intermediate Similarity | NPC242364 |
0.7831 | Intermediate Similarity | NPC320458 |
0.7831 | Intermediate Similarity | NPC81045 |
0.7831 | Intermediate Similarity | NPC21208 |
0.7831 | Intermediate Similarity | NPC233551 |
0.7831 | Intermediate Similarity | NPC234077 |
0.7831 | Intermediate Similarity | NPC61257 |
0.7831 | Intermediate Similarity | NPC169511 |
0.7831 | Intermediate Similarity | NPC133730 |
0.7831 | Intermediate Similarity | NPC40376 |
0.7831 | Intermediate Similarity | NPC151403 |
0.7831 | Intermediate Similarity | NPC280621 |
0.7831 | Intermediate Similarity | NPC171135 |
0.7831 | Intermediate Similarity | NPC261952 |
0.7831 | Intermediate Similarity | NPC287164 |
0.7831 | Intermediate Similarity | NPC20339 |
0.7831 | Intermediate Similarity | NPC39754 |
0.7831 | Intermediate Similarity | NPC191929 |
0.7831 | Intermediate Similarity | NPC48338 |
0.7831 | Intermediate Similarity | NPC172821 |
0.7831 | Intermediate Similarity | NPC100454 |
0.7831 | Intermediate Similarity | NPC89001 |
0.7831 | Intermediate Similarity | NPC473905 |
0.7831 | Intermediate Similarity | NPC274446 |
0.7821 | Intermediate Similarity | NPC471299 |
0.7821 | Intermediate Similarity | NPC270126 |
0.7805 | Intermediate Similarity | NPC284902 |
0.7805 | Intermediate Similarity | NPC469483 |
0.7805 | Intermediate Similarity | NPC47937 |
0.7792 | Intermediate Similarity | NPC41780 |
0.7792 | Intermediate Similarity | NPC476028 |
0.7792 | Intermediate Similarity | NPC187568 |
0.7792 | Intermediate Similarity | NPC171204 |
0.7792 | Intermediate Similarity | NPC476794 |
0.7792 | Intermediate Similarity | NPC141789 |
0.7792 | Intermediate Similarity | NPC470240 |
0.7778 | Intermediate Similarity | NPC194871 |
0.7763 | Intermediate Similarity | NPC244166 |
0.7746 | Intermediate Similarity | NPC133904 |
0.7738 | Intermediate Similarity | NPC42598 |
0.7738 | Intermediate Similarity | NPC81778 |
0.7738 | Intermediate Similarity | NPC477011 |
0.7738 | Intermediate Similarity | NPC91067 |
0.7738 | Intermediate Similarity | NPC477017 |
0.7738 | Intermediate Similarity | NPC318963 |
0.7738 | Intermediate Similarity | NPC473504 |
0.7738 | Intermediate Similarity | NPC20621 |
0.7738 | Intermediate Similarity | NPC139418 |
0.7738 | Intermediate Similarity | NPC14901 |
0.7738 | Intermediate Similarity | NPC477016 |
0.7738 | Intermediate Similarity | NPC40066 |
0.7738 | Intermediate Similarity | NPC280612 |
0.7738 | Intermediate Similarity | NPC93794 |
0.7738 | Intermediate Similarity | NPC130359 |
0.7733 | Intermediate Similarity | NPC295633 |
0.7733 | Intermediate Similarity | NPC58956 |
0.7733 | Intermediate Similarity | NPC269206 |
0.7722 | Intermediate Similarity | NPC474510 |
0.7722 | Intermediate Similarity | NPC281132 |
0.7714 | Intermediate Similarity | NPC44343 |
0.7714 | Intermediate Similarity | NPC68110 |
0.7714 | Intermediate Similarity | NPC179087 |
0.7714 | Intermediate Similarity | NPC210303 |
0.7711 | Intermediate Similarity | NPC475703 |
0.7692 | Intermediate Similarity | NPC471220 |
0.7683 | Intermediate Similarity | NPC215364 |
0.7681 | Intermediate Similarity | NPC79756 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC84038 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 |
---|---|---|---|
0.7531 | Intermediate Similarity | NPD4752 | Clinical (unspecified phase) |
0.726 | Intermediate Similarity | NPD2685 | Clinical (unspecified phase) |
0.7121 | Intermediate Similarity | NPD6927 | Phase 3 |
0.7108 | Intermediate Similarity | NPD5209 | Approved |
0.7089 | Intermediate Similarity | NPD8039 | Approved |
0.6914 | Remote Similarity | NPD4756 | Discovery |
0.6866 | Remote Similarity | NPD28 | Approved |
0.6866 | Remote Similarity | NPD29 | Approved |
0.686 | Remote Similarity | NPD1694 | Approved |
0.6854 | Remote Similarity | NPD5785 | Approved |
0.6854 | Remote Similarity | NPD6698 | Approved |
0.6854 | Remote Similarity | NPD46 | Approved |
0.6824 | Remote Similarity | NPD7154 | Phase 3 |
0.6824 | Remote Similarity | NPD5362 | Discontinued |
0.6711 | Remote Similarity | NPD6108 | Clinical (unspecified phase) |
0.6667 | Remote Similarity | NPD5363 | Approved |
0.6667 | Remote Similarity | NPD6082 | Clinical (unspecified phase) |
0.6667 | Remote Similarity | NPD3197 | Phase 1 |
0.6667 | Remote Similarity | NPD1733 | Clinical (unspecified phase) |
0.6571 | Remote Similarity | NPD3195 | Phase 2 |
0.6571 | Remote Similarity | NPD3196 | Approved |
0.6571 | Remote Similarity | NPD4266 | Approved |
0.6571 | Remote Similarity | NPD3194 | Approved |
0.6559 | Remote Similarity | NPD1698 | Clinical (unspecified phase) |
0.6556 | Remote Similarity | NPD1695 | Approved |
0.6486 | Remote Similarity | NPD4246 | Clinical (unspecified phase) |
0.6471 | Remote Similarity | NPD5790 | Clinical (unspecified phase) |
0.6444 | Remote Similarity | NPD6903 | Approved |
0.6429 | Remote Similarity | NPD5784 | Clinical (unspecified phase) |
0.6429 | Remote Similarity | NPD3172 | Approved |
0.6418 | Remote Similarity | NPD5343 | Approved |
0.6404 | Remote Similarity | NPD7146 | Approved |
0.6404 | Remote Similarity | NPD7521 | Approved |
0.6404 | Remote Similarity | NPD7334 | Approved |
0.6404 | Remote Similarity | NPD6409 | Approved |
0.6404 | Remote Similarity | NPD5330 | Approved |
0.6404 | Remote Similarity | NPD6684 | Approved |
0.64 | Remote Similarity | NPD7899 | Clinical (unspecified phase) |
0.6364 | Remote Similarity | NPD6400 | Clinical (unspecified phase) |
0.6337 | Remote Similarity | NPD6686 | Approved |
0.6322 | Remote Similarity | NPD6435 | Approved |
0.6322 | Remote Similarity | NPD4270 | Approved |
0.6322 | Remote Similarity | NPD4269 | Approved |
0.6316 | Remote Similarity | NPD2664 | Clinical (unspecified phase) |
0.6304 | Remote Similarity | NPD7838 | Discovery |
0.6279 | Remote Similarity | NPD4252 | Approved |
0.6264 | Remote Similarity | NPD6672 | Approved |
0.6264 | Remote Similarity | NPD7513 | Clinical (unspecified phase) |
0.6264 | Remote Similarity | NPD5737 | Approved |
0.625 | Remote Similarity | NPD5332 | Approved |
0.625 | Remote Similarity | NPD5331 | Approved |
0.6235 | Remote Similarity | NPD4271 | Approved |
0.6235 | Remote Similarity | NPD4268 | Approved |
0.6222 | Remote Similarity | NPD5786 | Approved |
0.6212 | Remote Similarity | NPD2699 | Approved |
0.6207 | Remote Similarity | NPD4790 | Discontinued |
0.6207 | Remote Similarity | NPD5369 | Approved |
0.6203 | Remote Similarity | NPD4247 | Clinical (unspecified phase) |
0.6186 | Remote Similarity | NPD7638 | Approved |
0.6154 | Remote Similarity | NPD4250 | Approved |
0.6154 | Remote Similarity | NPD4251 | Approved |
0.6122 | Remote Similarity | NPD7640 | Approved |
0.6122 | Remote Similarity | NPD7639 | Approved |
0.6119 | Remote Similarity | NPD3174 | Discontinued |
0.6092 | Remote Similarity | NPD5368 | Approved |
0.6092 | Remote Similarity | NPD4820 | Approved |
0.6092 | Remote Similarity | NPD4822 | Approved |
0.6092 | Remote Similarity | NPD4819 | Approved |
0.6092 | Remote Similarity | NPD4821 | Approved |
0.6076 | Remote Similarity | NPD3704 | Approved |
0.6076 | Remote Similarity | NPD7331 | Phase 2 |
0.6064 | Remote Similarity | NPD7983 | Approved |
0.6064 | Remote Similarity | NPD5693 | Phase 1 |
0.6058 | Remote Similarity | NPD6371 | Approved |
0.6044 | Remote Similarity | NPD6422 | Discontinued |
0.6044 | Remote Similarity | NPD4249 | Approved |
0.6026 | Remote Similarity | NPD5325 | Clinical (unspecified phase) |
0.602 | Remote Similarity | NPD8029 | Clinical (unspecified phase) |
0.602 | Remote Similarity | NPD4225 | Approved |
0.6 | Remote Similarity | NPD5779 | Approved |
0.6 | Remote Similarity | NPD5778 | Approved |
0.5974 | Remote Similarity | NPD3205 | Discontinued |
0.597 | Remote Similarity | NPD6097 | Approved |
0.597 | Remote Similarity | NPD6096 | Approved |
0.5943 | Remote Similarity | NPD6053 | Discontinued |
0.5942 | Remote Similarity | NPD6125 | Clinical (unspecified phase) |
0.5941 | Remote Similarity | NPD2258 | Approved |
0.5941 | Remote Similarity | NPD2259 | Approved |
0.5938 | Remote Similarity | NPD7901 | Clinical (unspecified phase) |
0.5938 | Remote Similarity | NPD7900 | Approved |
0.5938 | Remote Similarity | NPD7748 | Approved |
0.5905 | Remote Similarity | NPD2067 | Discontinued |
0.5882 | Remote Similarity | NPD1452 | Discontinued |
0.5876 | Remote Similarity | NPD6356 | Clinical (unspecified phase) |
0.5857 | Remote Similarity | NPD3173 | Approved |
0.5851 | Remote Similarity | NPD6904 | Approved |
0.5851 | Remote Similarity | NPD5764 | Clinical (unspecified phase) |
0.5851 | Remote Similarity | NPD5370 | Suspended |
0.5851 | Remote Similarity | NPD6080 | Approved |
0.5851 | Remote Similarity | NPD6673 | Approved |
0.5851 | Remote Similarity | NPD6051 | Approved |
0.5851 | Remote Similarity | NPD6101 | Approved |
0.5833 | Remote Similarity | NPD6399 | Phase 3 |
0.5816 | Remote Similarity | NPD7839 | Suspended |
0.5789 | Remote Similarity | NPD6109 | Phase 1 |
0.5784 | Remote Similarity | NPD6647 | Phase 2 |
0.5758 | Remote Similarity | NPD6084 | Phase 2 |
0.5758 | Remote Similarity | NPD7902 | Approved |
0.5758 | Remote Similarity | NPD6083 | Phase 2 |
0.5729 | Remote Similarity | NPD6411 | Approved |
0.5729 | Remote Similarity | NPD7515 | Phase 2 |
0.5729 | Remote Similarity | NPD4810 | Clinical (unspecified phase) |
0.5729 | Remote Similarity | NPD6050 | Approved |
0.5727 | Remote Similarity | NPD7115 | Discovery |
0.5714 | Remote Similarity | NPD5695 | Phase 3 |
0.5714 | Remote Similarity | NPD622 | Approved |
0.5701 | Remote Similarity | NPD2181 | Clinical (unspecified phase) |
0.5676 | Remote Similarity | NPD3728 | Approved |
0.5676 | Remote Similarity | NPD3730 | Approved |
0.5658 | Remote Similarity | NPD8779 | Phase 3 |
0.5644 | Remote Similarity | NPD6648 | Approved |
0.5638 | Remote Similarity | NPD3573 | Approved |
0.5625 | Remote Similarity | NPD5207 | Approved |
0.5625 | Remote Similarity | NPD5692 | Phase 3 |
0.5619 | Remote Similarity | NPD5954 | Clinical (unspecified phase) |
0.5612 | Remote Similarity | NPD5282 | Discontinued |
0.56 | Remote Similarity | NPD4627 | Clinical (unspecified phase) |
PubChem CID   | 10318257 |
ChEMBL   | CHEMBL484441 |
ZINC   |
Molecular Weight:   | 390.28 |
ALogP:   | -2.9672 |
MLogP:   | 3.66 |
XLogP:   | 8.308 |
# Rotatable Bonds:   | 17 |
Polar Surface Area:   | 52.6 |
# H-Bond Aceptor:   | 4 |
# H-Bond Donor:   | 0 |
# Rings:   | 2 |
# Heavy Atoms:   | 28 |