Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT16 | Organism | Staphylococcus aureus | Staphylococcus aureus | MIC | = | 32 | ug/ml | 20643902 |
NPT16 | Organism | Staphylococcus aureus | Staphylococcus aureus | MIC | = | 32 | ug/ml | 11975486 |
NPT16 | Organism | Staphylococcus aureus | Staphylococcus aureus | MIC | = | 32 | ug/ml | 23434030 |
NPT88 | Organism | Mycobacterium tuberculosis | Mycobacterium tuberculosis | MIC | = | 16 | ug/ml | 2832544 |
NPT16 | Organism | Staphylococcus aureus | Staphylococcus aureus | MIC | = | 16 | ug/ml | 12392745 |
NPT16 | Organism | Staphylococcus aureus | Staphylococcus aureus | MIC | = | 1 | ug/ml | 10397494 |
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 NPC158302 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 | NPC294748 |
1.0 | High Similarity | NPC146992 |
1.0 | High Similarity | NPC22742 |
1.0 | High Similarity | NPC85759 |
1.0 | High Similarity | NPC477344 |
1.0 | High Similarity | NPC477346 |
0.9733 | High Similarity | NPC126685 |
0.9733 | High Similarity | NPC44782 |
0.9733 | High Similarity | NPC472200 |
0.9733 | High Similarity | NPC307400 |
0.9733 | High Similarity | NPC186992 |
0.9733 | High Similarity | NPC119583 |
0.9733 | High Similarity | NPC472201 |
0.9733 | High Similarity | NPC297768 |
0.9733 | High Similarity | NPC477318 |
0.9733 | High Similarity | NPC115013 |
0.9733 | High Similarity | NPC238056 |
0.9733 | High Similarity | NPC184915 |
0.9733 | High Similarity | NPC259294 |
0.9733 | High Similarity | NPC477317 |
0.9733 | High Similarity | NPC477347 |
0.9733 | High Similarity | NPC472202 |
0.9733 | High Similarity | NPC169345 |
0.9733 | High Similarity | NPC472205 |
0.9733 | High Similarity | NPC173328 |
0.9733 | High Similarity | NPC475270 |
0.9733 | High Similarity | NPC183888 |
0.9733 | High Similarity | NPC477319 |
0.9733 | High Similarity | NPC290012 |
0.9733 | High Similarity | NPC475327 |
0.9733 | High Similarity | NPC475667 |
0.9733 | High Similarity | NPC476087 |
0.9733 | High Similarity | NPC472204 |
0.9733 | High Similarity | NPC477331 |
0.9733 | High Similarity | NPC472203 |
0.9733 | High Similarity | NPC269318 |
0.9733 | High Similarity | NPC89843 |
0.9733 | High Similarity | NPC143421 |
0.9733 | High Similarity | NPC224953 |
0.9733 | High Similarity | NPC123204 |
0.9733 | High Similarity | NPC27289 |
0.96 | High Similarity | NPC267592 |
0.9589 | High Similarity | NPC477350 |
0.9481 | High Similarity | NPC477332 |
0.9481 | High Similarity | NPC472352 |
0.9481 | High Similarity | NPC60849 |
0.9459 | High Similarity | NPC476782 |
0.9459 | High Similarity | NPC476781 |
0.9459 | High Similarity | NPC476783 |
0.9459 | High Similarity | NPC216883 |
0.9333 | High Similarity | NPC477325 |
0.9333 | High Similarity | NPC281563 |
0.9333 | High Similarity | NPC475425 |
0.9333 | High Similarity | NPC477328 |
0.9333 | High Similarity | NPC477326 |
0.9333 | High Similarity | NPC113745 |
0.9333 | High Similarity | NPC477320 |
0.9333 | High Similarity | NPC146380 |
0.9333 | High Similarity | NPC477329 |
0.9333 | High Similarity | NPC477323 |
0.9333 | High Similarity | NPC109887 |
0.9333 | High Similarity | NPC477330 |
0.9178 | High Similarity | NPC169085 |
0.9178 | High Similarity | NPC163812 |
0.9178 | High Similarity | NPC225748 |
0.9178 | High Similarity | NPC39266 |
0.9178 | High Similarity | NPC206823 |
0.9178 | High Similarity | NPC9763 |
0.8904 | High Similarity | NPC53760 |
0.8904 | High Similarity | NPC52268 |
0.8767 | High Similarity | NPC211428 |
0.8767 | High Similarity | NPC241265 |
0.8767 | High Similarity | NPC285003 |
0.8667 | High Similarity | NPC308096 |
0.8667 | High Similarity | NPC291228 |
0.863 | High Similarity | NPC97736 |
0.863 | High Similarity | NPC250619 |
0.863 | High Similarity | NPC50228 |
0.863 | High Similarity | NPC67099 |
0.8533 | High Similarity | NPC184550 |
0.8533 | High Similarity | NPC185419 |
0.8493 | Intermediate Similarity | NPC206601 |
0.8391 | Intermediate Similarity | NPC477348 |
0.8391 | Intermediate Similarity | NPC238264 |
0.8391 | Intermediate Similarity | NPC477345 |
0.8219 | Intermediate Similarity | NPC471760 |
0.8219 | Intermediate Similarity | NPC190418 |
0.8219 | Intermediate Similarity | NPC76881 |
0.8219 | Intermediate Similarity | NPC12040 |
0.8219 | Intermediate Similarity | NPC471761 |
0.8202 | Intermediate Similarity | NPC475375 |
0.8202 | Intermediate Similarity | NPC473765 |
0.8202 | Intermediate Similarity | NPC475593 |
0.8202 | Intermediate Similarity | NPC475164 |
0.8202 | Intermediate Similarity | NPC475525 |
0.8202 | Intermediate Similarity | NPC475241 |
0.8202 | Intermediate Similarity | NPC473605 |
0.8202 | Intermediate Similarity | NPC476066 |
0.8202 | Intermediate Similarity | NPC475540 |
0.8171 | Intermediate Similarity | NPC248415 |
0.8161 | Intermediate Similarity | NPC477349 |
0.7978 | Intermediate Similarity | NPC163409 |
0.7978 | Intermediate Similarity | NPC44682 |
0.7945 | Intermediate Similarity | NPC325773 |
0.7907 | Intermediate Similarity | NPC51662 |
0.7867 | Intermediate Similarity | NPC477752 |
0.7867 | Intermediate Similarity | NPC477756 |
0.7867 | Intermediate Similarity | NPC477751 |
0.7867 | Intermediate Similarity | NPC477764 |
0.7763 | Intermediate Similarity | NPC477758 |
0.7763 | Intermediate Similarity | NPC477761 |
0.7763 | Intermediate Similarity | NPC477759 |
0.7763 | Intermediate Similarity | NPC477754 |
0.7763 | Intermediate Similarity | NPC477760 |
0.7671 | Intermediate Similarity | NPC477763 |
0.7671 | Intermediate Similarity | NPC477762 |
0.7671 | Intermediate Similarity | NPC477755 |
0.7671 | Intermediate Similarity | NPC477750 |
0.7671 | Intermediate Similarity | NPC477753 |
0.7671 | Intermediate Similarity | NPC477757 |
0.7647 | Intermediate Similarity | NPC473500 |
0.7647 | Intermediate Similarity | NPC156089 |
0.7647 | Intermediate Similarity | NPC470313 |
0.7647 | Intermediate Similarity | NPC38295 |
0.76 | Intermediate Similarity | NPC6848 |
0.7586 | Intermediate Similarity | NPC470657 |
0.75 | Intermediate Similarity | NPC31349 |
0.75 | Intermediate Similarity | NPC314364 |
0.7449 | Intermediate Similarity | NPC126753 |
0.7423 | Intermediate Similarity | NPC469827 |
0.7412 | Intermediate Similarity | NPC21693 |
0.7412 | Intermediate Similarity | NPC236649 |
0.7397 | Intermediate Similarity | NPC317023 |
0.7374 | Intermediate Similarity | NPC207693 |
0.7349 | Intermediate Similarity | NPC474003 |
0.7312 | Intermediate Similarity | NPC215570 |
0.73 | Intermediate Similarity | NPC22709 |
0.7273 | Intermediate Similarity | NPC287269 |
0.726 | Intermediate Similarity | NPC472025 |
0.7245 | Intermediate Similarity | NPC231271 |
0.7245 | Intermediate Similarity | NPC470519 |
0.7228 | Intermediate Similarity | NPC470622 |
0.7228 | Intermediate Similarity | NPC471431 |
0.7222 | Intermediate Similarity | NPC470009 |
0.7216 | Intermediate Similarity | NPC310031 |
0.7216 | Intermediate Similarity | NPC80191 |
0.72 | Intermediate Similarity | NPC469826 |
0.7172 | Intermediate Similarity | NPC184805 |
0.7172 | Intermediate Similarity | NPC273189 |
0.7159 | Intermediate Similarity | NPC288471 |
0.7158 | Intermediate Similarity | NPC472273 |
0.7129 | Intermediate Similarity | NPC228190 |
0.7129 | Intermediate Similarity | NPC236753 |
0.7129 | Intermediate Similarity | NPC469825 |
0.7123 | Intermediate Similarity | NPC148424 |
0.7113 | Intermediate Similarity | NPC476611 |
0.71 | Intermediate Similarity | NPC471430 |
0.71 | Intermediate Similarity | NPC40716 |
0.71 | Intermediate Similarity | NPC475234 |
0.71 | Intermediate Similarity | NPC138219 |
0.71 | Intermediate Similarity | NPC475630 |
0.7097 | Intermediate Similarity | NPC320089 |
0.7087 | Intermediate Similarity | NPC157571 |
0.7083 | Intermediate Similarity | NPC471375 |
0.7083 | Intermediate Similarity | NPC209798 |
0.7083 | Intermediate Similarity | NPC471374 |
0.7079 | Intermediate Similarity | NPC83839 |
0.7071 | Intermediate Similarity | NPC267637 |
0.7067 | Intermediate Similarity | NPC470363 |
0.7053 | Intermediate Similarity | NPC143446 |
0.7041 | Intermediate Similarity | NPC94919 |
0.703 | Intermediate Similarity | NPC471626 |
0.703 | Intermediate Similarity | NPC92890 |
0.703 | Intermediate Similarity | NPC262567 |
0.703 | Intermediate Similarity | NPC202898 |
0.703 | Intermediate Similarity | NPC475319 |
0.703 | Intermediate Similarity | NPC473688 |
0.703 | Intermediate Similarity | NPC231566 |
0.7019 | Intermediate Similarity | NPC473826 |
0.7019 | Intermediate Similarity | NPC251263 |
0.7019 | Intermediate Similarity | NPC192600 |
0.7019 | Intermediate Similarity | NPC151543 |
0.7019 | Intermediate Similarity | NPC219180 |
0.7019 | Intermediate Similarity | NPC114287 |
0.7019 | Intermediate Similarity | NPC174720 |
0.7019 | Intermediate Similarity | NPC166422 |
0.7019 | Intermediate Similarity | NPC241909 |
0.7019 | Intermediate Similarity | NPC309714 |
0.7019 | Intermediate Similarity | NPC114304 |
0.7019 | Intermediate Similarity | NPC46665 |
0.7019 | Intermediate Similarity | NPC475287 |
0.7019 | Intermediate Similarity | NPC295823 |
0.7019 | Intermediate Similarity | NPC323341 |
0.7019 | Intermediate Similarity | NPC155410 |
0.7019 | Intermediate Similarity | NPC133818 |
0.7019 | Intermediate Similarity | NPC475467 |
0.701 | Intermediate Similarity | NPC471426 |
0.701 | Intermediate Similarity | NPC471428 |
0.701 | Intermediate Similarity | NPC51579 |
0.701 | Intermediate Similarity | NPC471427 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC158302 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 |
---|---|---|---|
0.8025 | Intermediate Similarity | NPD7329 | Approved |
0.7671 | Intermediate Similarity | NPD6123 | Approved |
0.7073 | Intermediate Similarity | NPD3181 | Approved |
0.69 | Remote Similarity | NPD8170 | Clinical (unspecified phase) |
0.6875 | Remote Similarity | NPD898 | Approved |
0.6875 | Remote Similarity | NPD896 | Approved |
0.6875 | Remote Similarity | NPD897 | Approved |
0.6869 | Remote Similarity | NPD8084 | Approved |
0.6869 | Remote Similarity | NPD8082 | Approved |
0.6869 | Remote Similarity | NPD8086 | Approved |
0.6869 | Remote Similarity | NPD8083 | Approved |
0.6869 | Remote Similarity | NPD8139 | Approved |
0.6869 | Remote Similarity | NPD8085 | Approved |
0.6869 | Remote Similarity | NPD8138 | Approved |
0.6857 | Remote Similarity | NPD8133 | Approved |
0.6849 | Remote Similarity | NPD7346 | Approved |
0.6849 | Remote Similarity | NPD3728 | Approved |
0.6849 | Remote Similarity | NPD3730 | Approved |
0.6832 | Remote Similarity | NPD8393 | Approved |
0.68 | Remote Similarity | NPD8275 | Approved |
0.68 | Remote Similarity | NPD8276 | Approved |
0.6733 | Remote Similarity | NPD8081 | Approved |
0.6712 | Remote Similarity | NPD891 | Phase 3 |
0.6712 | Remote Similarity | NPD888 | Phase 3 |
0.6712 | Remote Similarity | NPD890 | Clinical (unspecified phase) |
0.6712 | Remote Similarity | NPD892 | Phase 3 |
0.6712 | Remote Similarity | NPD893 | Approved |
0.6709 | Remote Similarity | NPD7909 | Approved |
0.6667 | Remote Similarity | NPD3670 | Clinical (unspecified phase) |
0.6667 | Remote Similarity | NPD3669 | Approved |
0.6667 | Remote Similarity | NPD8413 | Clinical (unspecified phase) |
0.6635 | Remote Similarity | NPD8132 | Clinical (unspecified phase) |
0.6627 | Remote Similarity | NPD7532 | Clinical (unspecified phase) |
0.6602 | Remote Similarity | NPD8307 | Discontinued |
0.6602 | Remote Similarity | NPD8140 | Approved |
0.6575 | Remote Similarity | NPD2269 | Approved |
0.6476 | Remote Similarity | NPD8306 | Approved |
0.6476 | Remote Similarity | NPD8305 | Approved |
0.6444 | Remote Similarity | NPD1780 | Approved |
0.6444 | Remote Similarity | NPD1779 | Approved |
0.6438 | Remote Similarity | NPD904 | Phase 3 |
0.6438 | Remote Similarity | NPD905 | Approved |
0.6429 | Remote Similarity | NPD8517 | Approved |
0.6429 | Remote Similarity | NPD8515 | Approved |
0.6429 | Remote Similarity | NPD8516 | Approved |
0.6415 | Remote Similarity | NPD8087 | Discontinued |
0.6392 | Remote Similarity | NPD8171 | Discontinued |
0.6381 | Remote Similarity | NPD6686 | Approved |
0.6373 | Remote Similarity | NPD7140 | Approved |
0.6373 | Remote Similarity | NPD7139 | Approved |
0.6373 | Remote Similarity | NPD7141 | Clinical (unspecified phase) |
0.6364 | Remote Similarity | NPD8295 | Clinical (unspecified phase) |
0.6283 | Remote Similarity | NPD8513 | Phase 3 |
0.6267 | Remote Similarity | NPD894 | Approved |
0.6267 | Remote Similarity | NPD889 | Approved |
0.6267 | Remote Similarity | NPD887 | Approved |
0.6267 | Remote Similarity | NPD895 | Approved |
0.6234 | Remote Similarity | NPD2267 | Suspended |
0.6195 | Remote Similarity | NPD8347 | Approved |
0.6195 | Remote Similarity | NPD8346 | Approved |
0.6195 | Remote Similarity | NPD8345 | Approved |
0.6186 | Remote Similarity | NPD6698 | Approved |
0.6186 | Remote Similarity | NPD46 | Approved |
0.6174 | Remote Similarity | NPD8328 | Phase 3 |
0.6173 | Remote Similarity | NPD8961 | Approved |
0.6132 | Remote Similarity | NPD6412 | Phase 2 |
0.6071 | Remote Similarity | NPD8137 | Clinical (unspecified phase) |
0.6058 | Remote Similarity | NPD8300 | Approved |
0.6058 | Remote Similarity | NPD8301 | Approved |
0.6027 | Remote Similarity | NPD6125 | Clinical (unspecified phase) |
0.6023 | Remote Similarity | NPD1811 | Approved |
0.6023 | Remote Similarity | NPD1810 | Approved |
0.6019 | Remote Similarity | NPD6941 | Approved |
0.5982 | Remote Similarity | NPD6940 | Discontinued |
0.5974 | Remote Similarity | NPD3729 | Clinical (unspecified phase) |
0.596 | Remote Similarity | NPD7983 | Approved |
0.5949 | Remote Similarity | NPD369 | Approved |
0.5934 | Remote Similarity | NPD4802 | Phase 2 |
0.5934 | Remote Similarity | NPD4238 | Approved |
0.5922 | Remote Similarity | NPD8029 | Clinical (unspecified phase) |
0.5862 | Remote Similarity | NPD8274 | Clinical (unspecified phase) |
0.5812 | Remote Similarity | NPD8080 | Discontinued |
0.5794 | Remote Similarity | NPD4057 | Clinical (unspecified phase) |
0.5794 | Remote Similarity | NPD4056 | Clinical (unspecified phase) |
0.5763 | Remote Similarity | NPD7829 | Approved |
0.5763 | Remote Similarity | NPD7830 | Approved |
0.5753 | Remote Similarity | NPD9000 | Phase 3 |
0.5753 | Remote Similarity | NPD8999 | Phase 3 |
0.5753 | Remote Similarity | NPD8998 | Phase 2 |
0.5753 | Remote Similarity | NPD8997 | Approved |
0.5753 | Remote Similarity | NPD8993 | Phase 1 |
0.575 | Remote Similarity | NPD8448 | Approved |
0.575 | Remote Similarity | NPD8959 | Approved |
0.5743 | Remote Similarity | NPD1446 | Phase 3 |
0.5743 | Remote Similarity | NPD1447 | Phase 3 |
0.5738 | Remote Similarity | NPD8391 | Approved |
0.5738 | Remote Similarity | NPD8392 | Approved |
0.5738 | Remote Similarity | NPD8390 | Approved |
0.5728 | Remote Similarity | NPD6428 | Approved |
0.5726 | Remote Similarity | NPD8444 | Approved |
0.5714 | Remote Similarity | NPD8299 | Approved |
0.5714 | Remote Similarity | NPD8341 | Approved |
0.5714 | Remote Similarity | NPD8340 | Approved |
0.5714 | Remote Similarity | NPD8342 | Approved |
0.5682 | Remote Similarity | NPD2686 | Approved |
0.5682 | Remote Similarity | NPD2687 | Approved |
0.5682 | Remote Similarity | NPD2254 | Approved |
0.5667 | Remote Similarity | NPD8451 | Approved |
0.5667 | Remote Similarity | NPD7507 | Approved |
0.5657 | Remote Similarity | NPD618 | Clinical (unspecified phase) |
0.5641 | Remote Similarity | NPD8377 | Approved |
0.5641 | Remote Similarity | NPD8294 | Approved |
0.5625 | Remote Similarity | NPD73 | Approved |
0.5619 | Remote Similarity | NPD2255 | Approved |
0.5616 | Remote Similarity | NPD2699 | Approved |
0.561 | Remote Similarity | NPD3198 | Approved |
0.5604 | Remote Similarity | NPD2257 | Approved |
0.5603 | Remote Similarity | NPD7641 | Discontinued |
0.56 | Remote Similarity | NPD8966 | Approved |
0.56 | Remote Similarity | NPD8965 | Approved |
PubChem CID   | 44575282 |
ChEMBL   | CHEMBL450741 |
ZINC   |
Molecular Weight:   | 1022.57 |
ALogP:   | -8.1444 |
MLogP:   | 4.65 |
XLogP:   | 5.547 |
# Rotatable Bonds:   | 31 |
Polar Surface Area:   | 294.35 |
# H-Bond Aceptor:   | 21 |
# H-Bond Donor:   | 7 |
# Rings:   | 5 |
# Heavy Atoms:   | 71 |