Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT181 | Cell Line | Bel-7402 | Homo sapiens | IC50 | > | 10000 | nM | 25136754 |
NPT179 | Cell Line | A2780 | Homo sapiens | IC50 | > | 10000 | nM | 20159656 |
NPT81 | Cell Line | A549 | Homo sapiens | IC50 | > | 10000 | nM | 23819871 |
NPT547 | Cell Line | BGC-823 | Homo sapiens | IC50 | > | 10000 | nM | 10.6019/CHEMBL1201861 |
NPT180 | Cell Line | HCT-8 | Homo sapiens | IC50 | > | 10000 | nM | 22037378 |
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 NPC171665 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 |
---|---|---|
0.9012 | High Similarity | NPC476628 |
0.8333 | Intermediate Similarity | NPC7382 |
0.8272 | Intermediate Similarity | NPC472013 |
0.8272 | Intermediate Similarity | NPC476624 |
0.8228 | Intermediate Similarity | NPC89374 |
0.8125 | Intermediate Similarity | NPC124289 |
0.8125 | Intermediate Similarity | NPC142759 |
0.8125 | Intermediate Similarity | NPC115719 |
0.8125 | Intermediate Similarity | NPC473437 |
0.8125 | Intermediate Similarity | NPC141346 |
0.8125 | Intermediate Similarity | NPC25908 |
0.8025 | Intermediate Similarity | NPC472014 |
0.7976 | Intermediate Similarity | NPC133844 |
0.7955 | Intermediate Similarity | NPC205548 |
0.7927 | Intermediate Similarity | NPC476627 |
0.7901 | Intermediate Similarity | NPC182848 |
0.7625 | Intermediate Similarity | NPC469737 |
0.7625 | Intermediate Similarity | NPC29328 |
0.7619 | Intermediate Similarity | NPC84185 |
0.7619 | Intermediate Similarity | NPC471890 |
0.7619 | Intermediate Similarity | NPC66677 |
0.7586 | Intermediate Similarity | NPC472957 |
0.7586 | Intermediate Similarity | NPC472958 |
0.7582 | Intermediate Similarity | NPC144629 |
0.7582 | Intermediate Similarity | NPC261607 |
0.7582 | Intermediate Similarity | NPC111114 |
0.7582 | Intermediate Similarity | NPC300312 |
0.7558 | Intermediate Similarity | NPC20262 |
0.7558 | Intermediate Similarity | NPC256750 |
0.7556 | Intermediate Similarity | NPC170775 |
0.7531 | Intermediate Similarity | NPC300940 |
0.7529 | Intermediate Similarity | NPC138492 |
0.7529 | Intermediate Similarity | NPC287817 |
0.7529 | Intermediate Similarity | NPC164218 |
0.7529 | Intermediate Similarity | NPC233352 |
0.7529 | Intermediate Similarity | NPC74445 |
0.7529 | Intermediate Similarity | NPC824 |
0.7529 | Intermediate Similarity | NPC30675 |
0.75 | Intermediate Similarity | NPC135776 |
0.75 | Intermediate Similarity | NPC125290 |
0.7473 | Intermediate Similarity | NPC77337 |
0.7444 | Intermediate Similarity | NPC472677 |
0.7444 | Intermediate Similarity | NPC58532 |
0.7419 | Intermediate Similarity | NPC167219 |
0.7412 | Intermediate Similarity | NPC32758 |
0.7412 | Intermediate Similarity | NPC301769 |
0.7391 | Intermediate Similarity | NPC476705 |
0.7375 | Intermediate Similarity | NPC67608 |
0.7375 | Intermediate Similarity | NPC469914 |
0.7363 | Intermediate Similarity | NPC32922 |
0.7349 | Intermediate Similarity | NPC77501 |
0.7342 | Intermediate Similarity | NPC476626 |
0.734 | Intermediate Similarity | NPC261341 |
0.7326 | Intermediate Similarity | NPC470946 |
0.7326 | Intermediate Similarity | NPC476625 |
0.7326 | Intermediate Similarity | NPC470947 |
0.7326 | Intermediate Similarity | NPC470945 |
0.732 | Intermediate Similarity | NPC474742 |
0.732 | Intermediate Similarity | NPC206079 |
0.7317 | Intermediate Similarity | NPC275098 |
0.7294 | Intermediate Similarity | NPC19443 |
0.7292 | Intermediate Similarity | NPC244411 |
0.7292 | Intermediate Similarity | NPC470541 |
0.7292 | Intermediate Similarity | NPC141191 |
0.7284 | Intermediate Similarity | NPC280256 |
0.7283 | Intermediate Similarity | NPC106510 |
0.7283 | Intermediate Similarity | NPC230332 |
0.7283 | Intermediate Similarity | NPC2946 |
0.7283 | Intermediate Similarity | NPC71533 |
0.7273 | Intermediate Similarity | NPC65350 |
0.7263 | Intermediate Similarity | NPC185553 |
0.7253 | Intermediate Similarity | NPC474854 |
0.7234 | Intermediate Similarity | NPC323008 |
0.7234 | Intermediate Similarity | NPC470010 |
0.7234 | Intermediate Similarity | NPC262133 |
0.7234 | Intermediate Similarity | NPC477131 |
0.7234 | Intermediate Similarity | NPC470013 |
0.7229 | Intermediate Similarity | NPC206875 |
0.7222 | Intermediate Similarity | NPC476043 |
0.7216 | Intermediate Similarity | NPC280963 |
0.7195 | Intermediate Similarity | NPC106309 |
0.7191 | Intermediate Similarity | NPC230527 |
0.7191 | Intermediate Similarity | NPC7927 |
0.7188 | Intermediate Similarity | NPC169205 |
0.7176 | Intermediate Similarity | NPC34110 |
0.7174 | Intermediate Similarity | NPC52198 |
0.7174 | Intermediate Similarity | NPC117405 |
0.7174 | Intermediate Similarity | NPC232747 |
0.7174 | Intermediate Similarity | NPC123912 |
0.7174 | Intermediate Similarity | NPC41217 |
0.7172 | Intermediate Similarity | NPC475871 |
0.7172 | Intermediate Similarity | NPC475945 |
0.7172 | Intermediate Similarity | NPC270046 |
0.7172 | Intermediate Similarity | NPC110989 |
0.7172 | Intermediate Similarity | NPC475873 |
0.7158 | Intermediate Similarity | NPC304886 |
0.7158 | Intermediate Similarity | NPC48803 |
0.7158 | Intermediate Similarity | NPC90121 |
0.7158 | Intermediate Similarity | NPC275960 |
0.7158 | Intermediate Similarity | NPC193645 |
0.7143 | Intermediate Similarity | NPC237540 |
0.7143 | Intermediate Similarity | NPC474011 |
0.7143 | Intermediate Similarity | NPC62670 |
0.7143 | Intermediate Similarity | NPC251435 |
0.7143 | Intermediate Similarity | NPC116139 |
0.7126 | Intermediate Similarity | NPC45495 |
0.7125 | Intermediate Similarity | NPC278895 |
0.7111 | Intermediate Similarity | NPC474853 |
0.7111 | Intermediate Similarity | NPC179006 |
0.71 | Intermediate Similarity | NPC474741 |
0.71 | Intermediate Similarity | NPC100487 |
0.71 | Intermediate Similarity | NPC203659 |
0.7097 | Intermediate Similarity | NPC62815 |
0.7093 | Intermediate Similarity | NPC192006 |
0.7089 | Intermediate Similarity | NPC61473 |
0.7083 | Intermediate Similarity | NPC135576 |
0.7083 | Intermediate Similarity | NPC93271 |
0.7083 | Intermediate Similarity | NPC9812 |
0.7071 | Intermediate Similarity | NPC66110 |
0.7071 | Intermediate Similarity | NPC474747 |
0.7071 | Intermediate Similarity | NPC225353 |
0.7065 | Intermediate Similarity | NPC476707 |
0.7065 | Intermediate Similarity | NPC476708 |
0.7065 | Intermediate Similarity | NPC476706 |
0.7065 | Intermediate Similarity | NPC91248 |
0.7059 | Intermediate Similarity | NPC239758 |
0.7059 | Intermediate Similarity | NPC151622 |
0.7059 | Intermediate Similarity | NPC71220 |
0.7059 | Intermediate Similarity | NPC137286 |
0.7059 | Intermediate Similarity | NPC469646 |
0.7059 | Intermediate Similarity | NPC472305 |
0.7059 | Intermediate Similarity | NPC215481 |
0.7059 | Intermediate Similarity | NPC7629 |
0.7053 | Intermediate Similarity | NPC298919 |
0.7053 | Intermediate Similarity | NPC90453 |
0.7053 | Intermediate Similarity | NPC198853 |
0.7053 | Intermediate Similarity | NPC469632 |
0.7045 | Intermediate Similarity | NPC275766 |
0.7041 | Intermediate Similarity | NPC306856 |
0.7037 | Intermediate Similarity | NPC476614 |
0.7037 | Intermediate Similarity | NPC476629 |
0.7033 | Intermediate Similarity | NPC472869 |
0.7033 | Intermediate Similarity | NPC194417 |
0.7033 | Intermediate Similarity | NPC472479 |
0.703 | Intermediate Similarity | NPC314244 |
0.703 | Intermediate Similarity | NPC223450 |
0.703 | Intermediate Similarity | NPC243998 |
0.7021 | Intermediate Similarity | NPC133698 |
0.7021 | Intermediate Similarity | NPC284185 |
0.7021 | Intermediate Similarity | NPC131209 |
0.7011 | Intermediate Similarity | NPC181195 |
0.7011 | Intermediate Similarity | NPC469617 |
0.7011 | Intermediate Similarity | NPC7232 |
0.7011 | Intermediate Similarity | NPC261125 |
0.701 | Intermediate Similarity | NPC477949 |
0.701 | Intermediate Similarity | NPC108475 |
0.701 | Intermediate Similarity | NPC170143 |
0.701 | Intermediate Similarity | NPC213947 |
0.7 | Intermediate Similarity | NPC90446 |
0.7 | Intermediate Similarity | NPC197089 |
0.6989 | Remote Similarity | NPC295312 |
0.6989 | Remote Similarity | NPC268298 |
0.6988 | Remote Similarity | NPC288667 |
0.6977 | Remote Similarity | NPC471061 |
0.6977 | Remote Similarity | NPC86917 |
0.697 | Remote Similarity | NPC472924 |
0.697 | Remote Similarity | NPC195192 |
0.697 | Remote Similarity | NPC475099 |
0.697 | Remote Similarity | NPC477950 |
0.697 | Remote Similarity | NPC304738 |
0.6966 | Remote Similarity | NPC227925 |
0.6966 | Remote Similarity | NPC92226 |
0.6966 | Remote Similarity | NPC279186 |
0.6957 | Remote Similarity | NPC72513 |
0.6947 | Remote Similarity | NPC131840 |
0.6947 | Remote Similarity | NPC125180 |
0.6941 | Remote Similarity | NPC244166 |
0.6941 | Remote Similarity | NPC201263 |
0.6939 | Remote Similarity | NPC64742 |
0.6932 | Remote Similarity | NPC472948 |
0.6923 | Remote Similarity | NPC257240 |
0.6923 | Remote Similarity | NPC261380 |
0.6923 | Remote Similarity | NPC477103 |
0.6923 | Remote Similarity | NPC137033 |
0.6915 | Remote Similarity | NPC253144 |
0.6915 | Remote Similarity | NPC129419 |
0.6915 | Remote Similarity | NPC472866 |
0.6915 | Remote Similarity | NPC145666 |
0.6907 | Remote Similarity | NPC184065 |
0.6907 | Remote Similarity | NPC471463 |
0.6905 | Remote Similarity | NPC247586 |
0.69 | Remote Similarity | NPC86077 |
0.6897 | Remote Similarity | NPC62336 |
0.6897 | Remote Similarity | NPC207772 |
0.6897 | Remote Similarity | NPC169095 |
0.6897 | Remote Similarity | NPC478122 |
0.6889 | Remote Similarity | NPC39588 |
0.6882 | Remote Similarity | NPC472870 |
0.6882 | Remote Similarity | NPC87189 |
0.6882 | Remote Similarity | NPC227379 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC171665 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 |
---|---|---|---|
0.7976 | Intermediate Similarity | NPD4800 | Clinical (unspecified phase) |
0.7158 | Intermediate Similarity | NPD1698 | Clinical (unspecified phase) |
0.7089 | Intermediate Similarity | NPD7341 | Phase 2 |
0.7 | Intermediate Similarity | NPD7331 | Phase 2 |
0.6923 | Remote Similarity | NPD5363 | Approved |
0.6923 | Remote Similarity | NPD6371 | Approved |
0.6848 | Remote Similarity | NPD5786 | Approved |
0.6848 | Remote Similarity | NPD3574 | Clinical (unspecified phase) |
0.6701 | Remote Similarity | NPD5282 | Discontinued |
0.6667 | Remote Similarity | NPD4623 | Approved |
0.6667 | Remote Similarity | NPD4519 | Discontinued |
0.6635 | Remote Similarity | NPD7899 | Clinical (unspecified phase) |
0.6593 | Remote Similarity | NPD4269 | Approved |
0.6593 | Remote Similarity | NPD4270 | Approved |
0.6562 | Remote Similarity | NPD5785 | Approved |
0.6458 | Remote Similarity | NPD1695 | Approved |
0.6429 | Remote Similarity | NPD5779 | Approved |
0.6429 | Remote Similarity | NPD5778 | Approved |
0.6413 | Remote Similarity | NPD4221 | Approved |
0.6413 | Remote Similarity | NPD4223 | Phase 3 |
0.6383 | Remote Similarity | NPD1696 | Phase 3 |
0.6374 | Remote Similarity | NPD4252 | Approved |
0.6374 | Remote Similarity | NPD4695 | Discontinued |
0.6344 | Remote Similarity | NPD5362 | Discontinued |
0.6333 | Remote Similarity | NPD5784 | Clinical (unspecified phase) |
0.6316 | Remote Similarity | NPD5690 | Phase 2 |
0.6304 | Remote Similarity | NPD5369 | Approved |
0.6277 | Remote Similarity | NPD4197 | Approved |
0.625 | Remote Similarity | NPD5211 | Phase 2 |
0.6238 | Remote Similarity | NPD4697 | Phase 3 |
0.622 | Remote Similarity | NPD2664 | Clinical (unspecified phase) |
0.6211 | Remote Similarity | NPD5329 | Approved |
0.6162 | Remote Similarity | NPD5284 | Approved |
0.6162 | Remote Similarity | NPD7983 | Approved |
0.6162 | Remote Similarity | NPD6079 | Approved |
0.6162 | Remote Similarity | NPD5281 | Approved |
0.6147 | Remote Similarity | NPD4634 | Approved |
0.6146 | Remote Similarity | NPD4694 | Approved |
0.6146 | Remote Similarity | NPD4688 | Approved |
0.6146 | Remote Similarity | NPD4693 | Phase 3 |
0.6146 | Remote Similarity | NPD5280 | Approved |
0.6146 | Remote Similarity | NPD5205 | Approved |
0.6146 | Remote Similarity | NPD4138 | Approved |
0.6146 | Remote Similarity | NPD4689 | Approved |
0.6146 | Remote Similarity | NPD4690 | Approved |
0.6139 | Remote Similarity | NPD4629 | Approved |
0.6139 | Remote Similarity | NPD5210 | Approved |
0.6132 | Remote Similarity | NPD5141 | Approved |
0.6122 | Remote Similarity | NPD4753 | Phase 2 |
0.6122 | Remote Similarity | NPD5328 | Approved |
0.6078 | Remote Similarity | NPD5221 | Approved |
0.6078 | Remote Similarity | NPD5220 | Clinical (unspecified phase) |
0.6078 | Remote Similarity | NPD5222 | Approved |
0.6058 | Remote Similarity | NPD5286 | Approved |
0.6058 | Remote Similarity | NPD5285 | Approved |
0.6058 | Remote Similarity | NPD4696 | Approved |
0.6042 | Remote Similarity | NPD1694 | Approved |
0.6042 | Remote Similarity | NPD1733 | Clinical (unspecified phase) |
0.6022 | Remote Similarity | NPD5368 | Approved |
0.602 | Remote Similarity | NPD4518 | Approved |
0.6019 | Remote Similarity | NPD5173 | Approved |
0.6019 | Remote Similarity | NPD4755 | Approved |
0.6 | Remote Similarity | NPD5223 | Approved |
0.6 | Remote Similarity | NPD6110 | Phase 1 |
0.6 | Remote Similarity | NPD7154 | Phase 3 |
0.5979 | Remote Similarity | NPD3618 | Phase 1 |
0.5979 | Remote Similarity | NPD5279 | Phase 3 |
0.5978 | Remote Similarity | NPD3617 | Approved |
0.5943 | Remote Similarity | NPD4633 | Approved |
0.5943 | Remote Similarity | NPD5224 | Approved |
0.5943 | Remote Similarity | NPD5225 | Approved |
0.5943 | Remote Similarity | NPD5226 | Approved |
0.5938 | Remote Similarity | NPD3665 | Phase 1 |
0.5938 | Remote Similarity | NPD3666 | Approved |
0.5938 | Remote Similarity | NPD3133 | Approved |
0.5922 | Remote Similarity | NPD7839 | Suspended |
0.5914 | Remote Similarity | NPD4195 | Approved |
0.5905 | Remote Similarity | NPD4700 | Approved |
0.59 | Remote Similarity | NPD4096 | Approved |
0.5895 | Remote Similarity | NPD6435 | Approved |
0.5895 | Remote Similarity | NPD5209 | Approved |
0.5895 | Remote Similarity | NPD4752 | Clinical (unspecified phase) |
0.5893 | Remote Similarity | NPD6053 | Discontinued |
0.5888 | Remote Similarity | NPD5175 | Approved |
0.5888 | Remote Similarity | NPD5174 | Approved |
0.587 | Remote Similarity | NPD4756 | Discovery |
0.5851 | Remote Similarity | NPD4821 | Approved |
0.5851 | Remote Similarity | NPD4820 | Approved |
0.5851 | Remote Similarity | NPD4819 | Approved |
0.5851 | Remote Similarity | NPD4822 | Approved |
0.5833 | Remote Similarity | NPD5332 | Approved |
0.5833 | Remote Similarity | NPD5331 | Approved |
0.5826 | Remote Similarity | NPD7115 | Discovery |
0.5825 | Remote Similarity | NPD5695 | Phase 3 |
0.581 | Remote Similarity | NPD5696 | Approved |
0.581 | Remote Similarity | NPD4225 | Approved |
0.5804 | Remote Similarity | NPD6649 | Approved |
0.5804 | Remote Similarity | NPD6650 | Approved |
0.58 | Remote Similarity | NPD5764 | Clinical (unspecified phase) |
0.58 | Remote Similarity | NPD6101 | Approved |
0.5794 | Remote Similarity | NPD5091 | Approved |
0.5789 | Remote Similarity | NPD4139 | Approved |
0.5789 | Remote Similarity | NPD857 | Phase 3 |
0.5789 | Remote Similarity | NPD4790 | Discontinued |
0.5789 | Remote Similarity | NPD4692 | Approved |
0.5784 | Remote Similarity | NPD5133 | Approved |
0.5784 | Remote Similarity | NPD6399 | Phase 3 |
0.5784 | Remote Similarity | NPD4202 | Approved |
0.5773 | Remote Similarity | NPD4786 | Approved |
0.5766 | Remote Similarity | NPD6373 | Approved |
0.5766 | Remote Similarity | NPD6372 | Approved |
0.5758 | Remote Similarity | NPD3573 | Approved |
0.5743 | Remote Similarity | NPD46 | Approved |
0.5743 | Remote Similarity | NPD6698 | Approved |
0.5741 | Remote Similarity | NPD4754 | Approved |
0.5729 | Remote Similarity | NPD3667 | Approved |
0.5727 | Remote Similarity | NPD5697 | Approved |
0.5714 | Remote Similarity | NPD6083 | Phase 2 |
0.5714 | Remote Similarity | NPD6084 | Phase 2 |
0.5702 | Remote Similarity | NPD4632 | Approved |
0.5686 | Remote Similarity | NPD5693 | Phase 1 |
0.5686 | Remote Similarity | NPD7637 | Suspended |
0.5686 | Remote Similarity | NPD6411 | Approved |
0.5678 | Remote Similarity | NPD6054 | Approved |
0.5678 | Remote Similarity | NPD6319 | Approved |
0.5676 | Remote Similarity | NPD6881 | Approved |
0.5676 | Remote Similarity | NPD6899 | Approved |
0.5676 | Remote Similarity | NPD6011 | Approved |
0.5676 | Remote Similarity | NPD4730 | Approved |
0.5676 | Remote Similarity | NPD4729 | Approved |
0.5676 | Remote Similarity | NPD5128 | Approved |
0.567 | Remote Similarity | NPD4788 | Approved |
0.566 | Remote Similarity | NPD8029 | Clinical (unspecified phase) |
0.5644 | Remote Similarity | NPD5370 | Suspended |
0.5644 | Remote Similarity | NPD7285 | Clinical (unspecified phase) |
0.5644 | Remote Similarity | NPD6673 | Approved |
0.5644 | Remote Similarity | NPD6904 | Approved |
0.5644 | Remote Similarity | NPD6080 | Approved |
0.5638 | Remote Similarity | NPD4268 | Approved |
0.5638 | Remote Similarity | NPD4271 | Approved |
0.5636 | Remote Similarity | NPD4768 | Approved |
0.5636 | Remote Similarity | NPD4767 | Approved |
0.5636 | Remote Similarity | NPD6675 | Approved |
0.5636 | Remote Similarity | NPD5739 | Approved |
0.5636 | Remote Similarity | NPD7128 | Approved |
0.5636 | Remote Similarity | NPD6402 | Approved |
0.5636 | Remote Similarity | NPD6008 | Approved |
0.563 | Remote Similarity | NPD6015 | Approved |
0.563 | Remote Similarity | NPD6016 | Approved |
0.5625 | Remote Similarity | NPD6012 | Approved |
0.5625 | Remote Similarity | NPD6013 | Approved |
0.5625 | Remote Similarity | NPD6014 | Approved |
0.5619 | Remote Similarity | NPD7614 | Phase 1 |
0.5607 | Remote Similarity | NPD7640 | Approved |
0.5607 | Remote Similarity | NPD7639 | Approved |
0.5607 | Remote Similarity | NPD6404 | Discontinued |
PubChem CID   | 60156050 |
ChEMBL   | CHEMBL2063009 |
ZINC   |
Molecular Weight:   | 266.15 |
ALogP:   | -0.2929 |
MLogP:   | 2.67 |
XLogP:   | -0.03 |
# Rotatable Bonds:   | 7 |
Polar Surface Area:   | 74.6 |
# H-Bond Aceptor:   | 4 |
# H-Bond Donor:   | 2 |
# Rings:   | 2 |
# Heavy Atoms:   | 19 |