Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT4409 | Individual Protein | Programmed cell death protein 4 | Homo sapiens | EC50 | = | 1500 | nM | 21539301 |
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 NPC133226 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 |
---|---|---|
1.0 | High Similarity | NPC470147 |
0.9865 | High Similarity | NPC180725 |
0.9865 | High Similarity | NPC470148 |
0.9865 | High Similarity | NPC470149 |
0.973 | High Similarity | NPC248775 |
0.9595 | High Similarity | NPC474026 |
0.9324 | High Similarity | NPC285840 |
0.9324 | High Similarity | NPC327041 |
0.9054 | High Similarity | NPC185186 |
0.9054 | High Similarity | NPC327383 |
0.8919 | High Similarity | NPC475762 |
0.8846 | High Similarity | NPC1180 |
0.8831 | High Similarity | NPC475711 |
0.878 | High Similarity | NPC208473 |
0.8625 | High Similarity | NPC469469 |
0.859 | High Similarity | NPC233071 |
0.8553 | High Similarity | NPC329890 |
0.8553 | High Similarity | NPC329914 |
0.8537 | High Similarity | NPC473308 |
0.8514 | High Similarity | NPC475760 |
0.8462 | Intermediate Similarity | NPC188860 |
0.8415 | Intermediate Similarity | NPC473315 |
0.8415 | Intermediate Similarity | NPC142111 |
0.8375 | Intermediate Similarity | NPC139712 |
0.8372 | Intermediate Similarity | NPC177668 |
0.8372 | Intermediate Similarity | NPC3952 |
0.8293 | Intermediate Similarity | NPC251026 |
0.8289 | Intermediate Similarity | NPC476012 |
0.8289 | Intermediate Similarity | NPC476037 |
0.8256 | Intermediate Similarity | NPC133450 |
0.8243 | Intermediate Similarity | NPC201356 |
0.8182 | Intermediate Similarity | NPC472196 |
0.8182 | Intermediate Similarity | NPC238090 |
0.8182 | Intermediate Similarity | NPC472195 |
0.8171 | Intermediate Similarity | NPC8538 |
0.8171 | Intermediate Similarity | NPC184208 |
0.8171 | Intermediate Similarity | NPC315731 |
0.8148 | Intermediate Similarity | NPC473947 |
0.814 | Intermediate Similarity | NPC40376 |
0.814 | Intermediate Similarity | NPC21208 |
0.814 | Intermediate Similarity | NPC470137 |
0.814 | Intermediate Similarity | NPC280621 |
0.814 | Intermediate Similarity | NPC20339 |
0.814 | Intermediate Similarity | NPC233551 |
0.814 | Intermediate Similarity | NPC48338 |
0.8118 | Intermediate Similarity | NPC47937 |
0.8108 | Intermediate Similarity | NPC19769 |
0.8108 | Intermediate Similarity | NPC96414 |
0.809 | Intermediate Similarity | NPC159698 |
0.809 | Intermediate Similarity | NPC256368 |
0.8025 | Intermediate Similarity | NPC477314 |
0.8023 | Intermediate Similarity | NPC178215 |
0.8022 | Intermediate Similarity | NPC475332 |
0.8 | Intermediate Similarity | NPC120398 |
0.8 | Intermediate Similarity | NPC182383 |
0.8 | Intermediate Similarity | NPC329615 |
0.8 | Intermediate Similarity | NPC471494 |
0.8 | Intermediate Similarity | NPC477014 |
0.8 | Intermediate Similarity | NPC322529 |
0.8 | Intermediate Similarity | NPC471567 |
0.8 | Intermediate Similarity | NPC329838 |
0.8 | Intermediate Similarity | NPC326661 |
0.8 | Intermediate Similarity | NPC477013 |
0.7973 | Intermediate Similarity | NPC148233 |
0.7973 | Intermediate Similarity | NPC25747 |
0.7955 | Intermediate Similarity | NPC473311 |
0.7955 | Intermediate Similarity | NPC239517 |
0.7955 | Intermediate Similarity | NPC473904 |
0.7931 | Intermediate Similarity | NPC320458 |
0.7931 | Intermediate Similarity | NPC473905 |
0.7931 | Intermediate Similarity | NPC89001 |
0.7907 | Intermediate Similarity | NPC279267 |
0.7907 | Intermediate Similarity | NPC103523 |
0.7907 | Intermediate Similarity | NPC134865 |
0.7907 | Intermediate Similarity | NPC62118 |
0.7907 | Intermediate Similarity | NPC69082 |
0.7907 | Intermediate Similarity | NPC231096 |
0.7907 | Intermediate Similarity | NPC477015 |
0.7907 | Intermediate Similarity | NPC114694 |
0.7907 | Intermediate Similarity | NPC107717 |
0.7907 | Intermediate Similarity | NPC171174 |
0.7907 | Intermediate Similarity | NPC475581 |
0.7907 | Intermediate Similarity | NPC142117 |
0.7907 | Intermediate Similarity | NPC311163 |
0.7907 | Intermediate Similarity | NPC240695 |
0.7907 | Intermediate Similarity | NPC232555 |
0.7901 | Intermediate Similarity | NPC477203 |
0.7882 | Intermediate Similarity | NPC163093 |
0.7882 | Intermediate Similarity | NPC156804 |
0.7882 | Intermediate Similarity | NPC78673 |
0.7882 | Intermediate Similarity | NPC160517 |
0.7882 | Intermediate Similarity | NPC186155 |
0.7841 | Intermediate Similarity | NPC477011 |
0.7841 | Intermediate Similarity | NPC318963 |
0.7841 | Intermediate Similarity | NPC477016 |
0.7841 | Intermediate Similarity | NPC139418 |
0.7841 | Intermediate Similarity | NPC40066 |
0.7841 | Intermediate Similarity | NPC93794 |
0.7841 | Intermediate Similarity | NPC81778 |
0.7841 | Intermediate Similarity | NPC473504 |
0.7841 | Intermediate Similarity | NPC20621 |
0.7841 | Intermediate Similarity | NPC91067 |
0.7841 | Intermediate Similarity | NPC42598 |
0.7841 | Intermediate Similarity | NPC477017 |
0.7816 | Intermediate Similarity | NPC118077 |
0.7816 | Intermediate Similarity | NPC258068 |
0.7816 | Intermediate Similarity | NPC475186 |
0.7816 | Intermediate Similarity | NPC20533 |
0.7816 | Intermediate Similarity | NPC476583 |
0.7791 | Intermediate Similarity | NPC470124 |
0.7791 | Intermediate Similarity | NPC103284 |
0.7791 | Intermediate Similarity | NPC473651 |
0.7791 | Intermediate Similarity | NPC107986 |
0.7791 | Intermediate Similarity | NPC1083 |
0.7791 | Intermediate Similarity | NPC223871 |
0.7791 | Intermediate Similarity | NPC110710 |
0.7791 | Intermediate Similarity | NPC132496 |
0.7791 | Intermediate Similarity | NPC66346 |
0.7791 | Intermediate Similarity | NPC82795 |
0.7791 | Intermediate Similarity | NPC231009 |
0.7791 | Intermediate Similarity | NPC283085 |
0.7791 | Intermediate Similarity | NPC473669 |
0.7791 | Intermediate Similarity | NPC473478 |
0.7791 | Intermediate Similarity | NPC286338 |
0.7778 | Intermediate Similarity | NPC109406 |
0.7778 | Intermediate Similarity | NPC469880 |
0.7778 | Intermediate Similarity | NPC477202 |
0.7765 | Intermediate Similarity | NPC253801 |
0.7763 | Intermediate Similarity | NPC146811 |
0.7763 | Intermediate Similarity | NPC276299 |
0.7763 | Intermediate Similarity | NPC124586 |
0.7742 | Intermediate Similarity | NPC475653 |
0.7727 | Intermediate Similarity | NPC261952 |
0.7727 | Intermediate Similarity | NPC39754 |
0.7727 | Intermediate Similarity | NPC151403 |
0.7727 | Intermediate Similarity | NPC61257 |
0.7727 | Intermediate Similarity | NPC171135 |
0.7727 | Intermediate Similarity | NPC191929 |
0.7727 | Intermediate Similarity | NPC100454 |
0.7727 | Intermediate Similarity | NPC274446 |
0.7727 | Intermediate Similarity | NPC169511 |
0.7727 | Intermediate Similarity | NPC81045 |
0.7727 | Intermediate Similarity | NPC287164 |
0.7727 | Intermediate Similarity | NPC320569 |
0.7727 | Intermediate Similarity | NPC242364 |
0.7727 | Intermediate Similarity | NPC234077 |
0.7727 | Intermediate Similarity | NPC172821 |
0.7727 | Intermediate Similarity | NPC133730 |
0.7717 | Intermediate Similarity | NPC173329 |
0.7717 | Intermediate Similarity | NPC255410 |
0.7717 | Intermediate Similarity | NPC472995 |
0.7717 | Intermediate Similarity | NPC288350 |
0.7703 | Intermediate Similarity | NPC26810 |
0.7701 | Intermediate Similarity | NPC219498 |
0.7701 | Intermediate Similarity | NPC134885 |
0.7701 | Intermediate Similarity | NPC308412 |
0.7701 | Intermediate Similarity | NPC219652 |
0.7701 | Intermediate Similarity | NPC293136 |
0.7701 | Intermediate Similarity | NPC61527 |
0.7701 | Intermediate Similarity | NPC25703 |
0.7701 | Intermediate Similarity | NPC134807 |
0.7701 | Intermediate Similarity | NPC132940 |
0.7701 | Intermediate Similarity | NPC210218 |
0.7701 | Intermediate Similarity | NPC241360 |
0.7701 | Intermediate Similarity | NPC204686 |
0.7701 | Intermediate Similarity | NPC473687 |
0.7701 | Intermediate Similarity | NPC309211 |
0.7701 | Intermediate Similarity | NPC473840 |
0.7701 | Intermediate Similarity | NPC282815 |
0.7674 | Intermediate Similarity | NPC266718 |
0.7674 | Intermediate Similarity | NPC475035 |
0.7674 | Intermediate Similarity | NPC474251 |
0.7667 | Intermediate Similarity | NPC206679 |
0.7667 | Intermediate Similarity | NPC476084 |
0.7667 | Intermediate Similarity | NPC471324 |
0.7667 | Intermediate Similarity | NPC469410 |
0.7667 | Intermediate Similarity | NPC476075 |
0.7667 | Intermediate Similarity | NPC114172 |
0.7647 | Intermediate Similarity | NPC73310 |
0.7647 | Intermediate Similarity | NPC145914 |
0.7647 | Intermediate Similarity | NPC65930 |
0.7647 | Intermediate Similarity | NPC94875 |
0.7647 | Intermediate Similarity | NPC475159 |
0.7647 | Intermediate Similarity | NPC473780 |
0.7647 | Intermediate Similarity | NPC329829 |
0.7647 | Intermediate Similarity | NPC473529 |
0.7647 | Intermediate Similarity | NPC473712 |
0.7647 | Intermediate Similarity | NPC180363 |
0.7647 | Intermediate Similarity | NPC131002 |
0.7647 | Intermediate Similarity | NPC11332 |
0.764 | Intermediate Similarity | NPC280612 |
0.764 | Intermediate Similarity | NPC130359 |
0.764 | Intermediate Similarity | NPC14901 |
0.7634 | Intermediate Similarity | NPC120299 |
0.7634 | Intermediate Similarity | NPC40812 |
0.7625 | Intermediate Similarity | NPC470435 |
0.7625 | Intermediate Similarity | NPC477085 |
0.7625 | Intermediate Similarity | NPC284006 |
0.7619 | Intermediate Similarity | NPC127295 |
0.7619 | Intermediate Similarity | NPC163362 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC133226 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 |
---|---|---|---|
0.8161 | Intermediate Similarity | NPD7838 | Discovery |
0.7753 | Intermediate Similarity | NPD6698 | Approved |
0.7753 | Intermediate Similarity | NPD46 | Approved |
0.7553 | Intermediate Similarity | NPD8029 | Clinical (unspecified phase) |
0.7396 | Intermediate Similarity | NPD5344 | Discontinued |
0.7283 | Intermediate Similarity | NPD7983 | Approved |
0.6939 | Remote Similarity | NPD6648 | Approved |
0.6762 | Remote Similarity | NPD8413 | Clinical (unspecified phase) |
0.6703 | Remote Similarity | NPD6400 | Clinical (unspecified phase) |
0.6699 | Remote Similarity | NPD7899 | Clinical (unspecified phase) |
0.6667 | Remote Similarity | NPD4250 | Approved |
0.6667 | Remote Similarity | NPD4251 | Approved |
0.6635 | Remote Similarity | NPD6686 | Approved |
0.6632 | Remote Similarity | NPD8522 | Clinical (unspecified phase) |
0.6629 | Remote Similarity | NPD5790 | Clinical (unspecified phase) |
0.6585 | Remote Similarity | NPD4247 | Clinical (unspecified phase) |
0.6559 | Remote Similarity | NPD4249 | Approved |
0.6509 | Remote Similarity | NPD6371 | Approved |
0.65 | Remote Similarity | NPD4225 | Approved |
0.6456 | Remote Similarity | NPD4246 | Clinical (unspecified phase) |
0.642 | Remote Similarity | NPD3197 | Phase 1 |
0.641 | Remote Similarity | NPD585 | Clinical (unspecified phase) |
0.6404 | Remote Similarity | NPD4271 | Approved |
0.6404 | Remote Similarity | NPD4268 | Approved |
0.63 | Remote Similarity | NPD4792 | Clinical (unspecified phase) |
0.63 | Remote Similarity | NPD7839 | Suspended |
0.6289 | Remote Similarity | NPD5785 | Approved |
0.6264 | Remote Similarity | NPD4821 | Approved |
0.6264 | Remote Similarity | NPD4819 | Approved |
0.6264 | Remote Similarity | NPD4822 | Approved |
0.6264 | Remote Similarity | NPD4820 | Approved |
0.6261 | Remote Similarity | NPD7829 | Approved |
0.6261 | Remote Similarity | NPD7830 | Approved |
0.6237 | Remote Similarity | NPD7154 | Phase 3 |
0.6228 | Remote Similarity | NPD7503 | Approved |
0.6228 | Remote Similarity | NPD8513 | Phase 3 |
0.6203 | Remote Similarity | NPD6109 | Phase 1 |
0.6203 | Remote Similarity | NPD9119 | Approved |
0.6203 | Remote Similarity | NPD69 | Approved |
0.6162 | Remote Similarity | NPD5779 | Approved |
0.6162 | Remote Similarity | NPD5778 | Approved |
0.6145 | Remote Similarity | NPD2685 | Clinical (unspecified phase) |
0.6117 | Remote Similarity | NPD7639 | Approved |
0.6117 | Remote Similarity | NPD7640 | Approved |
0.6111 | Remote Similarity | NPD4756 | Discovery |
0.6105 | Remote Similarity | NPD5363 | Approved |
0.6087 | Remote Similarity | NPD8516 | Approved |
0.6087 | Remote Similarity | NPD8515 | Approved |
0.6087 | Remote Similarity | NPD8517 | Approved |
0.6087 | Remote Similarity | NPD8033 | Approved |
0.6076 | Remote Similarity | NPD9118 | Approved |
0.6064 | Remote Similarity | NPD6110 | Phase 1 |
0.6061 | Remote Similarity | NPD7637 | Suspended |
0.6055 | Remote Similarity | NPD6421 | Discontinued |
0.6019 | Remote Similarity | NPD7638 | Approved |
0.6018 | Remote Similarity | NPD7505 | Discontinued |
0.6018 | Remote Similarity | NPD7115 | Discovery |
0.6 | Remote Similarity | NPD8294 | Approved |
0.6 | Remote Similarity | NPD8377 | Approved |
0.5983 | Remote Similarity | NPD7642 | Approved |
0.5965 | Remote Similarity | NPD7328 | Approved |
0.5965 | Remote Similarity | NPD7327 | Approved |
0.5948 | Remote Similarity | NPD8444 | Approved |
0.5948 | Remote Similarity | NPD8296 | Approved |
0.5948 | Remote Similarity | NPD8335 | Approved |
0.5948 | Remote Similarity | NPD8380 | Approved |
0.5948 | Remote Similarity | NPD8379 | Approved |
0.5948 | Remote Similarity | NPD8378 | Approved |
0.5946 | Remote Similarity | NPD6053 | Discontinued |
0.5943 | Remote Similarity | NPD1407 | Approved |
0.5938 | Remote Similarity | NPD6082 | Clinical (unspecified phase) |
0.5938 | Remote Similarity | NPD1733 | Clinical (unspecified phase) |
0.5913 | Remote Similarity | NPD7516 | Approved |
0.5895 | Remote Similarity | NPD5362 | Discontinued |
0.5882 | Remote Similarity | NPD8273 | Phase 1 |
0.5882 | Remote Similarity | NPD1698 | Clinical (unspecified phase) |
0.5833 | Remote Similarity | NPD8074 | Phase 3 |
0.5826 | Remote Similarity | NPD7641 | Discontinued |
0.5816 | Remote Similarity | NPD7524 | Approved |
0.5789 | Remote Similarity | NPD6435 | Approved |
0.5789 | Remote Similarity | NPD4269 | Approved |
0.5789 | Remote Similarity | NPD4270 | Approved |
0.575 | Remote Similarity | NPD8451 | Approved |
0.5745 | Remote Similarity | NPD4252 | Approved |
0.5739 | Remote Similarity | NPD7500 | Approved |
0.5729 | Remote Similarity | NPD5332 | Approved |
0.5729 | Remote Similarity | NPD5331 | Approved |
0.5714 | Remote Similarity | NPD8039 | Approved |
0.5714 | Remote Similarity | NPD7116 | Clinical (unspecified phase) |
0.5714 | Remote Similarity | NPD5786 | Approved |
0.5702 | Remote Similarity | NPD8448 | Approved |
0.5699 | Remote Similarity | NPD5784 | Clinical (unspecified phase) |
0.5696 | Remote Similarity | NPD4266 | Approved |
0.5696 | Remote Similarity | NPD3728 | Approved |
0.5696 | Remote Similarity | NPD3730 | Approved |
0.5696 | Remote Similarity | NPD3196 | Approved |
0.5696 | Remote Similarity | NPD3194 | Approved |
0.5696 | Remote Similarity | NPD3195 | Phase 2 |
0.5684 | Remote Similarity | NPD4790 | Discontinued |
0.5676 | Remote Similarity | NPD4061 | Clinical (unspecified phase) |
0.567 | Remote Similarity | NPD7338 | Clinical (unspecified phase) |
0.5667 | Remote Similarity | NPD8342 | Approved |
0.5667 | Remote Similarity | NPD8340 | Approved |
0.5667 | Remote Similarity | NPD8299 | Approved |
0.5667 | Remote Similarity | NPD8341 | Approved |
0.5625 | Remote Similarity | NPD5209 | Approved |
0.562 | Remote Similarity | NPD7507 | Approved |
PubChem CID   | 54583047 |
ChEMBL   | CHEMBL1784375 |
ZINC   |
Molecular Weight:   | 586.41 |
ALogP:   | -7.8862 |
MLogP:   | 3.99 |
XLogP:   | 7.087 |
# Rotatable Bonds:   | 33 |
Polar Surface Area:   | 153.75 |
# H-Bond Aceptor:   | 9 |
# H-Bond Donor:   | 5 |
# Rings:   | 1 |
# Heavy Atoms:   | 41 |