Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT170 | Cell Line | SK-MEL-28 | Homo sapiens | IC50 | = | 62000 | nM | 22445674 |
NPT114 | Cell Line | LoVo | Homo sapiens | IC50 | = | 24000 | nM | 18529046 |
NPT81 | Cell Line | A549 | Homo sapiens | IC50 | = | 64000 | nM | 20405847 |
NPT2 | Others | Unspecified | IC50 | = | 60000 | nM | 17190440 | |
NPT2 | Others | Unspecified | IC50 | = | 33000 | nM | 18973387 | |
NPT306 | Cell Line | PC-3 | Homo sapiens | IC50 | = | 48000 | nM | 17145798 |
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 NPC174273 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 |
---|---|---|
0.8851 | High Similarity | NPC239453 |
0.8851 | High Similarity | NPC224552 |
0.8571 | High Similarity | NPC299714 |
0.8571 | High Similarity | NPC257510 |
0.8391 | Intermediate Similarity | NPC313115 |
0.828 | Intermediate Similarity | NPC156912 |
0.8191 | Intermediate Similarity | NPC92231 |
0.8191 | Intermediate Similarity | NPC34732 |
0.8118 | Intermediate Similarity | NPC476610 |
0.8111 | Intermediate Similarity | NPC188896 |
0.8072 | Intermediate Similarity | NPC476605 |
0.7912 | Intermediate Similarity | NPC131453 |
0.7831 | Intermediate Similarity | NPC476609 |
0.7816 | Intermediate Similarity | NPC113024 |
0.7765 | Intermediate Similarity | NPC476606 |
0.7727 | Intermediate Similarity | NPC311891 |
0.7701 | Intermediate Similarity | NPC129501 |
0.7647 | Intermediate Similarity | NPC35397 |
0.7647 | Intermediate Similarity | NPC477923 |
0.7647 | Intermediate Similarity | NPC474946 |
0.7647 | Intermediate Similarity | NPC66566 |
0.7614 | Intermediate Similarity | NPC287749 |
0.7586 | Intermediate Similarity | NPC274750 |
0.7586 | Intermediate Similarity | NPC215307 |
0.7558 | Intermediate Similarity | NPC61080 |
0.7558 | Intermediate Similarity | NPC265588 |
0.7529 | Intermediate Similarity | NPC243342 |
0.7529 | Intermediate Similarity | NPC477138 |
0.7525 | Intermediate Similarity | NPC133921 |
0.75 | Intermediate Similarity | NPC242992 |
0.75 | Intermediate Similarity | NPC471268 |
0.75 | Intermediate Similarity | NPC471271 |
0.75 | Intermediate Similarity | NPC167706 |
0.7471 | Intermediate Similarity | NPC477924 |
0.7442 | Intermediate Similarity | NPC291503 |
0.7356 | Intermediate Similarity | NPC476607 |
0.7356 | Intermediate Similarity | NPC274079 |
0.7356 | Intermediate Similarity | NPC477925 |
0.7333 | Intermediate Similarity | NPC474531 |
0.7326 | Intermediate Similarity | NPC91858 |
0.7317 | Intermediate Similarity | NPC250977 |
0.7303 | Intermediate Similarity | NPC476603 |
0.7294 | Intermediate Similarity | NPC475077 |
0.7294 | Intermediate Similarity | NPC242001 |
0.7284 | Intermediate Similarity | NPC225415 |
0.7273 | Intermediate Similarity | NPC471798 |
0.7262 | Intermediate Similarity | NPC476604 |
0.7222 | Intermediate Similarity | NPC236112 |
0.7222 | Intermediate Similarity | NPC13554 |
0.7209 | Intermediate Similarity | NPC471799 |
0.7209 | Intermediate Similarity | NPC68443 |
0.7209 | Intermediate Similarity | NPC182717 |
0.7191 | Intermediate Similarity | NPC83351 |
0.7191 | Intermediate Similarity | NPC167891 |
0.7176 | Intermediate Similarity | NPC145498 |
0.7176 | Intermediate Similarity | NPC92801 |
0.7174 | Intermediate Similarity | NPC207013 |
0.7159 | Intermediate Similarity | NPC167873 |
0.7159 | Intermediate Similarity | NPC1973 |
0.7143 | Intermediate Similarity | NPC471270 |
0.7143 | Intermediate Similarity | NPC208999 |
0.7143 | Intermediate Similarity | NPC244790 |
0.7128 | Intermediate Similarity | NPC94462 |
0.7126 | Intermediate Similarity | NPC201048 |
0.7126 | Intermediate Similarity | NPC471797 |
0.7126 | Intermediate Similarity | NPC476366 |
0.7111 | Intermediate Similarity | NPC291379 |
0.7111 | Intermediate Similarity | NPC328714 |
0.7111 | Intermediate Similarity | NPC31330 |
0.7097 | Intermediate Similarity | NPC238992 |
0.7093 | Intermediate Similarity | NPC110799 |
0.7093 | Intermediate Similarity | NPC471272 |
0.7093 | Intermediate Similarity | NPC164022 |
0.7093 | Intermediate Similarity | NPC477792 |
0.7079 | Intermediate Similarity | NPC470711 |
0.7079 | Intermediate Similarity | NPC130136 |
0.7079 | Intermediate Similarity | NPC91594 |
0.7079 | Intermediate Similarity | NPC470758 |
0.7073 | Intermediate Similarity | NPC290367 |
0.7065 | Intermediate Similarity | NPC47763 |
0.7065 | Intermediate Similarity | NPC471408 |
0.7065 | Intermediate Similarity | NPC30166 |
0.7059 | Intermediate Similarity | NPC9942 |
0.7053 | Intermediate Similarity | NPC109900 |
0.7033 | Intermediate Similarity | NPC471266 |
0.7033 | Intermediate Similarity | NPC22403 |
0.7033 | Intermediate Similarity | NPC96362 |
0.7033 | Intermediate Similarity | NPC474592 |
0.7033 | Intermediate Similarity | NPC95124 |
0.7033 | Intermediate Similarity | NPC236707 |
0.7021 | Intermediate Similarity | NPC290731 |
0.7011 | Intermediate Similarity | NPC95165 |
0.7 | Intermediate Similarity | NPC474989 |
0.7 | Intermediate Similarity | NPC285761 |
0.7 | Intermediate Similarity | NPC470396 |
0.7 | Intermediate Similarity | NPC99168 |
0.7 | Intermediate Similarity | NPC275910 |
0.7 | Intermediate Similarity | NPC22955 |
0.6989 | Remote Similarity | NPC317458 |
0.6989 | Remote Similarity | NPC159168 |
0.6989 | Remote Similarity | NPC253402 |
0.6979 | Remote Similarity | NPC133588 |
0.6966 | Remote Similarity | NPC106432 |
0.6966 | Remote Similarity | NPC315261 |
0.6966 | Remote Similarity | NPC470749 |
0.6957 | Remote Similarity | NPC476646 |
0.6957 | Remote Similarity | NPC142163 |
0.6957 | Remote Similarity | NPC6707 |
0.6957 | Remote Similarity | NPC249423 |
0.6947 | Remote Similarity | NPC237344 |
0.6947 | Remote Similarity | NPC475069 |
0.6947 | Remote Similarity | NPC175145 |
0.6941 | Remote Similarity | NPC471238 |
0.6932 | Remote Similarity | NPC78527 |
0.6932 | Remote Similarity | NPC100334 |
0.6932 | Remote Similarity | NPC306727 |
0.6932 | Remote Similarity | NPC237510 |
0.6932 | Remote Similarity | NPC475793 |
0.6923 | Remote Similarity | NPC273410 |
0.6923 | Remote Similarity | NPC472463 |
0.6923 | Remote Similarity | NPC233295 |
0.6923 | Remote Similarity | NPC80530 |
0.6923 | Remote Similarity | NPC53744 |
0.6915 | Remote Similarity | NPC474493 |
0.6907 | Remote Similarity | NPC115607 |
0.6907 | Remote Similarity | NPC97103 |
0.6907 | Remote Similarity | NPC329643 |
0.6889 | Remote Similarity | NPC157996 |
0.6889 | Remote Similarity | NPC101475 |
0.6889 | Remote Similarity | NPC472805 |
0.6889 | Remote Similarity | NPC283619 |
0.6889 | Remote Similarity | NPC198968 |
0.6889 | Remote Similarity | NPC155986 |
0.6889 | Remote Similarity | NPC34177 |
0.6889 | Remote Similarity | NPC318495 |
0.6889 | Remote Similarity | NPC90979 |
0.6889 | Remote Similarity | NPC40394 |
0.6889 | Remote Similarity | NPC214570 |
0.6882 | Remote Similarity | NPC49964 |
0.6882 | Remote Similarity | NPC87489 |
0.6882 | Remote Similarity | NPC296701 |
0.6882 | Remote Similarity | NPC7988 |
0.6882 | Remote Similarity | NPC218616 |
0.6875 | Remote Similarity | NPC476948 |
0.6867 | Remote Similarity | NPC144650 |
0.686 | Remote Similarity | NPC476431 |
0.686 | Remote Similarity | NPC210323 |
0.6854 | Remote Similarity | NPC32832 |
0.6848 | Remote Similarity | NPC164840 |
0.6848 | Remote Similarity | NPC241290 |
0.6848 | Remote Similarity | NPC15714 |
0.6848 | Remote Similarity | NPC209944 |
0.6848 | Remote Similarity | NPC236237 |
0.6848 | Remote Similarity | NPC322313 |
0.6848 | Remote Similarity | NPC102253 |
0.6837 | Remote Similarity | NPC204188 |
0.6837 | Remote Similarity | NPC475751 |
0.6837 | Remote Similarity | NPC329596 |
0.6837 | Remote Similarity | NPC291484 |
0.6837 | Remote Similarity | NPC80561 |
0.6837 | Remote Similarity | NPC3345 |
0.6837 | Remote Similarity | NPC11216 |
0.6837 | Remote Similarity | NPC473956 |
0.6818 | Remote Similarity | NPC476422 |
0.6818 | Remote Similarity | NPC220939 |
0.6818 | Remote Similarity | NPC265485 |
0.6813 | Remote Similarity | NPC148977 |
0.6813 | Remote Similarity | NPC244385 |
0.6813 | Remote Similarity | NPC230295 |
0.6813 | Remote Similarity | NPC300499 |
0.6813 | Remote Similarity | NPC11908 |
0.6813 | Remote Similarity | NPC476314 |
0.6813 | Remote Similarity | NPC138621 |
0.6813 | Remote Similarity | NPC158662 |
0.6813 | Remote Similarity | NPC196753 |
0.6813 | Remote Similarity | NPC253807 |
0.6813 | Remote Similarity | NPC167037 |
0.6813 | Remote Similarity | NPC6978 |
0.6813 | Remote Similarity | NPC98386 |
0.6809 | Remote Similarity | NPC82538 |
0.6809 | Remote Similarity | NPC237795 |
0.6809 | Remote Similarity | NPC185605 |
0.6809 | Remote Similarity | NPC474634 |
0.6809 | Remote Similarity | NPC23748 |
0.6804 | Remote Similarity | NPC475664 |
0.6804 | Remote Similarity | NPC474668 |
0.6782 | Remote Similarity | NPC34834 |
0.6778 | Remote Similarity | NPC265328 |
0.6778 | Remote Similarity | NPC237460 |
0.6778 | Remote Similarity | NPC113733 |
0.6778 | Remote Similarity | NPC129165 |
0.6778 | Remote Similarity | NPC63958 |
0.6778 | Remote Similarity | NPC300324 |
0.6778 | Remote Similarity | NPC134330 |
0.6778 | Remote Similarity | NPC73875 |
0.6778 | Remote Similarity | NPC321016 |
0.6778 | Remote Similarity | NPC107059 |
0.6778 | Remote Similarity | NPC470362 |
0.6778 | Remote Similarity | NPC321381 |
0.6778 | Remote Similarity | NPC120098 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC174273 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 |
---|---|---|---|
0.6966 | Remote Similarity | NPD6933 | Approved |
0.6848 | Remote Similarity | NPD7525 | Registered |
0.6742 | Remote Similarity | NPD6926 | Approved |
0.6742 | Remote Similarity | NPD6924 | Approved |
0.6739 | Remote Similarity | NPD7645 | Phase 2 |
0.6667 | Remote Similarity | NPD6942 | Approved |
0.6667 | Remote Similarity | NPD7339 | Approved |
0.6667 | Remote Similarity | NPD8264 | Approved |
0.6593 | Remote Similarity | NPD3701 | Clinical (unspecified phase) |
0.6517 | Remote Similarity | NPD7150 | Approved |
0.6517 | Remote Similarity | NPD7151 | Approved |
0.6517 | Remote Similarity | NPD7152 | Approved |
0.6489 | Remote Similarity | NPD7509 | Discontinued |
0.6404 | Remote Similarity | NPD7143 | Approved |
0.6404 | Remote Similarity | NPD7144 | Approved |
0.6364 | Remote Similarity | NPD7524 | Approved |
0.6344 | Remote Similarity | NPD6932 | Approved |
0.6316 | Remote Similarity | NPD6931 | Approved |
0.6316 | Remote Similarity | NPD6930 | Phase 2 |
0.6292 | Remote Similarity | NPD6922 | Approved |
0.6292 | Remote Similarity | NPD6923 | Approved |
0.6277 | Remote Similarity | NPD7322 | Clinical (unspecified phase) |
0.6224 | Remote Similarity | NPD4786 | Approved |
0.6211 | Remote Similarity | NPD6929 | Approved |
0.6196 | Remote Similarity | NPD4784 | Approved |
0.6196 | Remote Similarity | NPD4785 | Approved |
0.6186 | Remote Similarity | NPD3667 | Approved |
0.6146 | Remote Similarity | NPD4748 | Discontinued |
0.6146 | Remote Similarity | NPD7332 | Phase 2 |
0.6146 | Remote Similarity | NPD7514 | Phase 3 |
0.6122 | Remote Similarity | NPD6695 | Phase 3 |
0.6117 | Remote Similarity | NPD6079 | Approved |
0.6105 | Remote Similarity | NPD7145 | Approved |
0.61 | Remote Similarity | NPD3618 | Phase 1 |
0.6078 | Remote Similarity | NPD5328 | Approved |
0.6061 | Remote Similarity | NPD7338 | Clinical (unspecified phase) |
0.6042 | Remote Similarity | NPD6683 | Phase 2 |
0.604 | Remote Similarity | NPD4751 | Clinical (unspecified phase) |
0.6 | Remote Similarity | NPD6925 | Approved |
0.6 | Remote Similarity | NPD6893 | Approved |
0.6 | Remote Similarity | NPD5776 | Phase 2 |
0.5978 | Remote Similarity | NPD4243 | Approved |
0.5963 | Remote Similarity | NPD5344 | Discontinued |
0.5962 | Remote Similarity | NPD7515 | Phase 2 |
0.5926 | Remote Similarity | NPD4225 | Approved |
0.5918 | Remote Similarity | NPD6902 | Approved |
0.5918 | Remote Similarity | NPD6898 | Phase 1 |
0.5905 | Remote Similarity | NPD4202 | Approved |
0.5882 | Remote Similarity | NPD7750 | Discontinued |
0.5862 | Remote Similarity | NPD368 | Approved |
0.5766 | Remote Similarity | NPD7632 | Discontinued |
0.5761 | Remote Similarity | NPD4267 | Clinical (unspecified phase) |
0.5743 | Remote Similarity | NPD3666 | Approved |
0.5743 | Remote Similarity | NPD3665 | Phase 1 |
0.5743 | Remote Similarity | NPD3133 | Approved |
0.5741 | Remote Similarity | NPD5222 | Approved |
0.5741 | Remote Similarity | NPD5220 | Clinical (unspecified phase) |
0.5741 | Remote Similarity | NPD5221 | Approved |
0.5727 | Remote Similarity | NPD5286 | Approved |
0.5727 | Remote Similarity | NPD5285 | Approved |
0.5727 | Remote Similarity | NPD4696 | Approved |
0.5714 | Remote Similarity | NPD4195 | Approved |
0.5714 | Remote Similarity | NPD3168 | Discontinued |
0.5701 | Remote Similarity | NPD7748 | Approved |
0.5688 | Remote Similarity | NPD5173 | Approved |
0.5688 | Remote Similarity | NPD4755 | Approved |
0.5686 | Remote Similarity | NPD7520 | Clinical (unspecified phase) |
0.5676 | Remote Similarity | NPD4159 | Approved |
0.5676 | Remote Similarity | NPD5223 | Approved |
0.566 | Remote Similarity | NPD6411 | Approved |
0.566 | Remote Similarity | NPD7087 | Discontinued |
0.5657 | Remote Similarity | NPD8259 | Clinical (unspecified phase) |
0.5636 | Remote Similarity | NPD5290 | Discontinued |
0.5636 | Remote Similarity | NPD7638 | Approved |
0.5631 | Remote Similarity | NPD5279 | Phase 3 |
0.5625 | Remote Similarity | NPD5224 | Approved |
0.5625 | Remote Similarity | NPD4190 | Phase 3 |
0.5625 | Remote Similarity | NPD5225 | Approved |
0.5625 | Remote Similarity | NPD5275 | Approved |
0.5625 | Remote Similarity | NPD4633 | Approved |
0.5625 | Remote Similarity | NPD5226 | Approved |
0.5625 | Remote Similarity | NPD5211 | Phase 2 |
0.5607 | Remote Similarity | NPD6399 | Phase 3 |
PubChem CID   | 46232273 |
ChEMBL   | CHEMBL599325 |
ZINC   |
Molecular Weight:   | 384.17 |
ALogP:   | 2.0296 |
MLogP:   | 3.33 |
XLogP:   | 6.268 |
# Rotatable Bonds:   | 8 |
Polar Surface Area:   | 40.46 |
# H-Bond Aceptor:   | 2 |
# H-Bond Donor:   | 2 |
# Rings:   | 2 |
# Heavy Atoms:   | 23 |