Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT2 | Others | Unspecified | Inhibition | = | 0 | % | 7714535 | |
NPT2 | Others | Unspecified | Inhibition | = | 17 | % | 7714535 | |
NPT2 | Others | Unspecified | Inhibition | = | 36 | % | 7714535 | |
NPT2 | Others | Unspecified | Inhibition | = | 52 | % | 7714535 | |
NPT2 | Others | Unspecified | Inhibition | = | 67 | % | 7714535 | |
NPT2 | Others | Unspecified | Inhibition | = | 85 | % | 7714535 | |
NPT2 | Others | Unspecified | Inhibition | = | 27 | % | 7714535 | |
NPT2 | Others | Unspecified | Inhibition | = | 62 | % | 7714535 | |
NPT2 | Others | Unspecified | Inhibition | = | 79 | % | 7714535 | |
NPT2 | Others | Unspecified | Inhibition | = | 90 | % | 7714535 | |
NPT2 | Others | Unspecified | IC50 | = | 160000 | nM | 7714535 |
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 NPC114345 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 | NPC303230 |
1.0 | High Similarity | NPC6099 |
0.9767 | High Similarity | NPC327760 |
0.7935 | Intermediate Similarity | NPC47937 |
0.7826 | Intermediate Similarity | NPC182383 |
0.7822 | Intermediate Similarity | NPC159533 |
0.7778 | Intermediate Similarity | NPC35717 |
0.7767 | Intermediate Similarity | NPC266514 |
0.7766 | Intermediate Similarity | NPC20339 |
0.7766 | Intermediate Similarity | NPC233551 |
0.7766 | Intermediate Similarity | NPC280621 |
0.7766 | Intermediate Similarity | NPC48338 |
0.7766 | Intermediate Similarity | NPC40376 |
0.7766 | Intermediate Similarity | NPC21208 |
0.7742 | Intermediate Similarity | NPC232555 |
0.7742 | Intermediate Similarity | NPC475581 |
0.7742 | Intermediate Similarity | NPC231096 |
0.7742 | Intermediate Similarity | NPC107717 |
0.7742 | Intermediate Similarity | NPC142117 |
0.7742 | Intermediate Similarity | NPC240695 |
0.7742 | Intermediate Similarity | NPC62118 |
0.7742 | Intermediate Similarity | NPC171174 |
0.7742 | Intermediate Similarity | NPC114694 |
0.7736 | Intermediate Similarity | NPC66108 |
0.7701 | Intermediate Similarity | NPC478195 |
0.7701 | Intermediate Similarity | NPC478196 |
0.7701 | Intermediate Similarity | NPC478194 |
0.7701 | Intermediate Similarity | NPC478192 |
0.7701 | Intermediate Similarity | NPC478191 |
0.7701 | Intermediate Similarity | NPC478193 |
0.7684 | Intermediate Similarity | NPC130359 |
0.7684 | Intermediate Similarity | NPC14901 |
0.7667 | Intermediate Similarity | NPC47653 |
0.7664 | Intermediate Similarity | NPC478212 |
0.766 | Intermediate Similarity | NPC178215 |
0.7634 | Intermediate Similarity | NPC1083 |
0.7634 | Intermediate Similarity | NPC307126 |
0.7634 | Intermediate Similarity | NPC107986 |
0.7634 | Intermediate Similarity | NPC473651 |
0.7634 | Intermediate Similarity | NPC473669 |
0.7634 | Intermediate Similarity | NPC473478 |
0.7634 | Intermediate Similarity | NPC120398 |
0.7634 | Intermediate Similarity | NPC82795 |
0.7634 | Intermediate Similarity | NPC110710 |
0.7634 | Intermediate Similarity | NPC231009 |
0.7634 | Intermediate Similarity | NPC68303 |
0.7634 | Intermediate Similarity | NPC223871 |
0.7634 | Intermediate Similarity | NPC283085 |
0.7634 | Intermediate Similarity | NPC103284 |
0.7634 | Intermediate Similarity | NPC132496 |
0.7634 | Intermediate Similarity | NPC471567 |
0.7634 | Intermediate Similarity | NPC66346 |
0.7634 | Intermediate Similarity | NPC286338 |
0.7604 | Intermediate Similarity | NPC239517 |
0.7604 | Intermediate Similarity | NPC473904 |
0.76 | Intermediate Similarity | NPC300584 |
0.7596 | Intermediate Similarity | NPC469853 |
0.7579 | Intermediate Similarity | NPC191929 |
0.7579 | Intermediate Similarity | NPC320569 |
0.7579 | Intermediate Similarity | NPC242364 |
0.7579 | Intermediate Similarity | NPC274446 |
0.7579 | Intermediate Similarity | NPC171135 |
0.7579 | Intermediate Similarity | NPC133730 |
0.7579 | Intermediate Similarity | NPC172821 |
0.7579 | Intermediate Similarity | NPC234077 |
0.7579 | Intermediate Similarity | NPC151403 |
0.7579 | Intermediate Similarity | NPC39754 |
0.7579 | Intermediate Similarity | NPC100454 |
0.7579 | Intermediate Similarity | NPC169511 |
0.7579 | Intermediate Similarity | NPC61257 |
0.7579 | Intermediate Similarity | NPC261952 |
0.7579 | Intermediate Similarity | NPC81045 |
0.7579 | Intermediate Similarity | NPC287164 |
0.7576 | Intermediate Similarity | NPC473333 |
0.7573 | Intermediate Similarity | NPC296950 |
0.7553 | Intermediate Similarity | NPC473687 |
0.7553 | Intermediate Similarity | NPC134807 |
0.7553 | Intermediate Similarity | NPC112685 |
0.7553 | Intermediate Similarity | NPC219498 |
0.7553 | Intermediate Similarity | NPC103523 |
0.7553 | Intermediate Similarity | NPC69082 |
0.7553 | Intermediate Similarity | NPC279267 |
0.7553 | Intermediate Similarity | NPC308412 |
0.7553 | Intermediate Similarity | NPC210218 |
0.7553 | Intermediate Similarity | NPC204686 |
0.7553 | Intermediate Similarity | NPC134885 |
0.7553 | Intermediate Similarity | NPC134865 |
0.7547 | Intermediate Similarity | NPC478211 |
0.7547 | Intermediate Similarity | NPC478209 |
0.7545 | Intermediate Similarity | NPC108581 |
0.7545 | Intermediate Similarity | NPC478205 |
0.7545 | Intermediate Similarity | NPC478206 |
0.7528 | Intermediate Similarity | NPC47844 |
0.7528 | Intermediate Similarity | NPC141195 |
0.7527 | Intermediate Similarity | NPC163093 |
0.7527 | Intermediate Similarity | NPC156804 |
0.7526 | Intermediate Similarity | NPC142838 |
0.75 | Intermediate Similarity | NPC40066 |
0.75 | Intermediate Similarity | NPC318963 |
0.75 | Intermediate Similarity | NPC139418 |
0.75 | Intermediate Similarity | NPC20621 |
0.75 | Intermediate Similarity | NPC2666 |
0.75 | Intermediate Similarity | NPC473504 |
0.75 | Intermediate Similarity | NPC91067 |
0.75 | Intermediate Similarity | NPC81778 |
0.75 | Intermediate Similarity | NPC477011 |
0.75 | Intermediate Similarity | NPC42598 |
0.75 | Intermediate Similarity | NPC93794 |
0.7477 | Intermediate Similarity | NPC100329 |
0.7477 | Intermediate Similarity | NPC247031 |
0.7477 | Intermediate Similarity | NPC132790 |
0.7477 | Intermediate Similarity | NPC97939 |
0.7476 | Intermediate Similarity | NPC118902 |
0.7476 | Intermediate Similarity | NPC104161 |
0.7476 | Intermediate Similarity | NPC469980 |
0.7474 | Intermediate Similarity | NPC472007 |
0.7471 | Intermediate Similarity | NPC144419 |
0.7455 | Intermediate Similarity | NPC478204 |
0.7453 | Intermediate Similarity | NPC38154 |
0.7453 | Intermediate Similarity | NPC478210 |
0.7447 | Intermediate Similarity | NPC329838 |
0.7447 | Intermediate Similarity | NPC329615 |
0.7447 | Intermediate Similarity | NPC322529 |
0.7447 | Intermediate Similarity | NPC477013 |
0.7447 | Intermediate Similarity | NPC477014 |
0.7423 | Intermediate Similarity | NPC274075 |
0.7423 | Intermediate Similarity | NPC474232 |
0.7419 | Intermediate Similarity | NPC185256 |
0.7416 | Intermediate Similarity | NPC190400 |
0.7416 | Intermediate Similarity | NPC49392 |
0.7404 | Intermediate Similarity | NPC121099 |
0.7404 | Intermediate Similarity | NPC146731 |
0.74 | Intermediate Similarity | NPC477921 |
0.7396 | Intermediate Similarity | NPC320458 |
0.7396 | Intermediate Similarity | NPC475819 |
0.7396 | Intermediate Similarity | NPC89001 |
0.7396 | Intermediate Similarity | NPC473715 |
0.7396 | Intermediate Similarity | NPC473905 |
0.7396 | Intermediate Similarity | NPC136879 |
0.7379 | Intermediate Similarity | NPC295791 |
0.7379 | Intermediate Similarity | NPC140591 |
0.7379 | Intermediate Similarity | NPC197835 |
0.7379 | Intermediate Similarity | NPC291500 |
0.7379 | Intermediate Similarity | NPC189609 |
0.7379 | Intermediate Similarity | NPC303653 |
0.7379 | Intermediate Similarity | NPC39996 |
0.7368 | Intermediate Similarity | NPC472009 |
0.7368 | Intermediate Similarity | NPC132940 |
0.7368 | Intermediate Similarity | NPC241360 |
0.7368 | Intermediate Similarity | NPC469910 |
0.7368 | Intermediate Similarity | NPC293136 |
0.7368 | Intermediate Similarity | NPC477015 |
0.7358 | Intermediate Similarity | NPC264819 |
0.7347 | Intermediate Similarity | NPC473321 |
0.734 | Intermediate Similarity | NPC469809 |
0.7339 | Intermediate Similarity | NPC475966 |
0.7333 | Intermediate Similarity | NPC475711 |
0.7333 | Intermediate Similarity | NPC478208 |
0.7333 | Intermediate Similarity | NPC34768 |
0.7333 | Intermediate Similarity | NPC469852 |
0.732 | Intermediate Similarity | NPC218927 |
0.732 | Intermediate Similarity | NPC206001 |
0.732 | Intermediate Similarity | NPC477016 |
0.732 | Intermediate Similarity | NPC280612 |
0.732 | Intermediate Similarity | NPC477017 |
0.7312 | Intermediate Similarity | NPC11383 |
0.7312 | Intermediate Similarity | NPC65930 |
0.7312 | Intermediate Similarity | NPC475159 |
0.7312 | Intermediate Similarity | NPC310450 |
0.7312 | Intermediate Similarity | NPC329829 |
0.7312 | Intermediate Similarity | NPC473529 |
0.7312 | Intermediate Similarity | NPC253364 |
0.7312 | Intermediate Similarity | NPC145914 |
0.7312 | Intermediate Similarity | NPC11332 |
0.7312 | Intermediate Similarity | NPC73310 |
0.7312 | Intermediate Similarity | NPC94875 |
0.7312 | Intermediate Similarity | NPC180363 |
0.7312 | Intermediate Similarity | NPC474959 |
0.7312 | Intermediate Similarity | NPC475046 |
0.7312 | Intermediate Similarity | NPC473712 |
0.7312 | Intermediate Similarity | NPC473780 |
0.7312 | Intermediate Similarity | NPC131002 |
0.7303 | Intermediate Similarity | NPC469414 |
0.7303 | Intermediate Similarity | NPC329826 |
0.73 | Intermediate Similarity | NPC471142 |
0.73 | Intermediate Similarity | NPC477922 |
0.73 | Intermediate Similarity | NPC471492 |
0.7297 | Intermediate Similarity | NPC53396 |
0.7297 | Intermediate Similarity | NPC98249 |
0.7292 | Intermediate Similarity | NPC20533 |
0.7292 | Intermediate Similarity | NPC258068 |
0.7292 | Intermediate Similarity | NPC473995 |
0.7292 | Intermediate Similarity | NPC476583 |
0.7283 | Intermediate Similarity | NPC162741 |
0.7283 | Intermediate Similarity | NPC91332 |
0.7273 | Intermediate Similarity | NPC29798 |
0.7273 | Intermediate Similarity | NPC473723 |
0.7273 | Intermediate Similarity | NPC295204 |
0.7273 | Intermediate Similarity | NPC473663 |
0.7273 | Intermediate Similarity | NPC162205 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC114345 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 |
---|---|---|---|
0.7245 | Intermediate Similarity | NPD46 | Approved |
0.7245 | Intermediate Similarity | NPD6698 | Approved |
0.7172 | Intermediate Similarity | NPD7983 | Approved |
0.6957 | Remote Similarity | NPD4756 | Discovery |
0.6931 | Remote Similarity | NPD5779 | Approved |
0.6931 | Remote Similarity | NPD5778 | Approved |
0.6923 | Remote Similarity | NPD4225 | Approved |
0.6897 | Remote Similarity | NPD8516 | Approved |
0.6897 | Remote Similarity | NPD8513 | Phase 3 |
0.6897 | Remote Similarity | NPD8515 | Approved |
0.6897 | Remote Similarity | NPD8517 | Approved |
0.6757 | Remote Similarity | NPD6371 | Approved |
0.6733 | Remote Similarity | NPD7838 | Discovery |
0.6667 | Remote Similarity | NPD4061 | Clinical (unspecified phase) |
0.6636 | Remote Similarity | NPD7899 | Clinical (unspecified phase) |
0.6612 | Remote Similarity | NPD8074 | Phase 3 |
0.6604 | Remote Similarity | NPD8029 | Clinical (unspecified phase) |
0.6552 | Remote Similarity | NPD7115 | Discovery |
0.6531 | Remote Similarity | NPD7154 | Phase 3 |
0.65 | Remote Similarity | NPD4249 | Approved |
0.6481 | Remote Similarity | NPD5344 | Discontinued |
0.6476 | Remote Similarity | NPD1698 | Clinical (unspecified phase) |
0.646 | Remote Similarity | NPD5955 | Clinical (unspecified phase) |
0.6436 | Remote Similarity | NPD4250 | Approved |
0.6436 | Remote Similarity | NPD4251 | Approved |
0.6429 | Remote Similarity | NPD6686 | Approved |
0.6415 | Remote Similarity | NPD7839 | Suspended |
0.6408 | Remote Similarity | NPD5785 | Approved |
0.6389 | Remote Similarity | NPD6648 | Approved |
0.6389 | Remote Similarity | NPD7639 | Approved |
0.6389 | Remote Similarity | NPD7640 | Approved |
0.6381 | Remote Similarity | NPD5282 | Discontinued |
0.6348 | Remote Similarity | NPD6053 | Discontinued |
0.6311 | Remote Similarity | NPD6101 | Approved |
0.6311 | Remote Similarity | NPD5764 | Clinical (unspecified phase) |
0.6296 | Remote Similarity | NPD7638 | Approved |
0.6261 | Remote Similarity | NPD8413 | Clinical (unspecified phase) |
0.6238 | Remote Similarity | NPD1733 | Clinical (unspecified phase) |
0.6238 | Remote Similarity | NPD1694 | Approved |
0.6238 | Remote Similarity | NPD5363 | Approved |
0.6222 | Remote Similarity | NPD3704 | Approved |
0.62 | Remote Similarity | NPD6110 | Phase 1 |
0.6195 | Remote Similarity | NPD5954 | Clinical (unspecified phase) |
0.619 | Remote Similarity | NPD7637 | Suspended |
0.619 | Remote Similarity | NPD6411 | Approved |
0.6154 | Remote Similarity | NPD4247 | Clinical (unspecified phase) |
0.6139 | Remote Similarity | NPD6400 | Clinical (unspecified phase) |
0.6111 | Remote Similarity | NPD7319 | Approved |
0.61 | Remote Similarity | NPD4269 | Approved |
0.61 | Remote Similarity | NPD4270 | Approved |
0.6061 | Remote Similarity | NPD4252 | Approved |
0.6061 | Remote Similarity | NPD5790 | Clinical (unspecified phase) |
0.6019 | Remote Similarity | NPD5786 | Approved |
0.6 | Remote Similarity | NPD7507 | Approved |
0.6 | Remote Similarity | NPD1695 | Approved |
0.6 | Remote Similarity | NPD5345 | Clinical (unspecified phase) |
0.5984 | Remote Similarity | NPD6319 | Approved |
0.5982 | Remote Similarity | NPD7632 | Discontinued |
0.5968 | Remote Similarity | NPD7829 | Approved |
0.5968 | Remote Similarity | NPD7830 | Approved |
0.5941 | Remote Similarity | NPD5209 | Approved |
0.5935 | Remote Similarity | NPD7503 | Approved |
0.5897 | Remote Similarity | NPD2067 | Discontinued |
0.5889 | Remote Similarity | NPD2664 | Clinical (unspecified phase) |
0.5882 | Remote Similarity | NPD5362 | Discontinued |
0.5876 | Remote Similarity | NPD8039 | Approved |
0.5873 | Remote Similarity | NPD8273 | Phase 1 |
0.5868 | Remote Similarity | NPD7500 | Approved |
0.5859 | Remote Similarity | NPD4271 | Approved |
0.5859 | Remote Similarity | NPD4268 | Approved |
0.5843 | Remote Similarity | NPD4246 | Clinical (unspecified phase) |
0.5842 | Remote Similarity | NPD5369 | Approved |
0.584 | Remote Similarity | NPD7642 | Approved |
0.584 | Remote Similarity | NPD8328 | Phase 3 |
0.5824 | Remote Similarity | NPD3197 | Phase 1 |
0.5806 | Remote Similarity | NPD8444 | Approved |
0.5795 | Remote Similarity | NPD69 | Approved |
0.5795 | Remote Similarity | NPD9119 | Approved |
0.5784 | Remote Similarity | NPD4752 | Clinical (unspecified phase) |
0.5769 | Remote Similarity | NPD6082 | Clinical (unspecified phase) |
0.5769 | Remote Similarity | NPD7260 | Phase 2 |
0.5769 | Remote Similarity | NPD1696 | Phase 3 |
0.5766 | Remote Similarity | NPD7902 | Approved |
0.575 | Remote Similarity | NPD4632 | Approved |
0.5748 | Remote Similarity | NPD8451 | Approved |
0.5743 | Remote Similarity | NPD4822 | Approved |
0.5743 | Remote Similarity | NPD4820 | Approved |
0.5743 | Remote Similarity | NPD4821 | Approved |
0.5743 | Remote Similarity | NPD4819 | Approved |
0.5741 | Remote Similarity | NPD4810 | Clinical (unspecified phase) |
0.5738 | Remote Similarity | NPD8295 | Clinical (unspecified phase) |
0.5703 | Remote Similarity | NPD8448 | Approved |
0.5701 | Remote Similarity | NPD5370 | Suspended |
0.5691 | Remote Similarity | NPD7327 | Approved |
0.5691 | Remote Similarity | NPD7328 | Approved |
0.5691 | Remote Similarity | NPD7641 | Discontinued |
0.569 | Remote Similarity | NPD7128 | Approved |
0.569 | Remote Similarity | NPD6008 | Approved |
0.569 | Remote Similarity | NPD6402 | Approved |
0.569 | Remote Similarity | NPD5739 | Approved |
0.569 | Remote Similarity | NPD6675 | Approved |
0.5688 | Remote Similarity | NPD6399 | Phase 3 |
0.5682 | Remote Similarity | NPD9118 | Approved |
0.568 | Remote Similarity | NPD8033 | Approved |
0.5678 | Remote Similarity | NPD8132 | Clinical (unspecified phase) |
0.5678 | Remote Similarity | NPD6373 | Approved |
0.5678 | Remote Similarity | NPD6372 | Approved |
0.5672 | Remote Similarity | NPD7966 | Clinical (unspecified phase) |
0.5669 | Remote Similarity | NPD7492 | Approved |
0.5669 | Remote Similarity | NPD8340 | Approved |
0.5669 | Remote Similarity | NPD8342 | Approved |
0.5669 | Remote Similarity | NPD8299 | Approved |
0.5669 | Remote Similarity | NPD8341 | Approved |
0.5645 | Remote Similarity | NPD7516 | Approved |
0.5641 | Remote Similarity | NPD6412 | Phase 2 |
0.5641 | Remote Similarity | NPD5697 | Approved |
0.5641 | Remote Similarity | NPD5701 | Approved |
0.5636 | Remote Similarity | NPD7748 | Approved |
0.5635 | Remote Similarity | NPD8080 | Discontinued |
0.5631 | Remote Similarity | NPD6435 | Approved |
0.563 | Remote Similarity | NPD4634 | Approved |
0.5625 | Remote Similarity | NPD6616 | Approved |
0.561 | Remote Similarity | NPD8137 | Clinical (unspecified phase) |
0.5606 | Remote Similarity | NPD6845 | Suspended |
0.56 | Remote Similarity | NPD6054 | Approved |
0.56 | Remote Similarity | NPD6059 | Approved |
0.56 | Remote Similarity | NPD8294 | Approved |
0.56 | Remote Similarity | NPD8377 | Approved |
PubChem CID   | 10036567 |
ChEMBL   | CHEMBL513448 |
ZINC   |
Molecular Weight:   | 224.10 |
ALogP:   | -1.2216 |
MLogP:   | 2.34 |
XLogP:   | 1.183 |
# Rotatable Bonds:   | 5 |
Polar Surface Area:   | 66.76 |
# H-Bond Aceptor:   | 4 |
# H-Bond Donor:   | 2 |
# Rings:   | 2 |
# Heavy Atoms:   | 16 |