Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT2 | Others | Unspecified | IC50 | = | 7300 | nM | 19093848 | |
NPT165 | Cell Line | HeLa | Homo sapiens | IC50 | = | 23000 | nM | 17524651 |
NPT2 | Others | Unspecified | IC50 | = | 16500 | nM | DrugMatrix in vitro pharmacology data | |
NPT15 | Cell Line | Jurkat | Homo sapiens | IC50 | = | 7550 | nM | 18411326 |
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 NPC247826 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 |
---|---|---|
0.9286 | High Similarity | NPC231784 |
0.8235 | Intermediate Similarity | NPC5361 |
0.7805 | Intermediate Similarity | NPC470173 |
0.7778 | Intermediate Similarity | NPC253123 |
0.7667 | Intermediate Similarity | NPC470175 |
0.75 | Intermediate Similarity | NPC476709 |
0.7442 | Intermediate Similarity | NPC470176 |
0.7386 | Intermediate Similarity | NPC476701 |
0.7356 | Intermediate Similarity | NPC476703 |
0.7349 | Intermediate Similarity | NPC16964 |
0.7333 | Intermediate Similarity | NPC477390 |
0.7333 | Intermediate Similarity | NPC477385 |
0.7273 | Intermediate Similarity | NPC477089 |
0.7241 | Intermediate Similarity | NPC293223 |
0.7241 | Intermediate Similarity | NPC470174 |
0.7176 | Intermediate Similarity | NPC306085 |
0.7159 | Intermediate Similarity | NPC244002 |
0.7158 | Intermediate Similarity | NPC133450 |
0.7143 | Intermediate Similarity | NPC20072 |
0.7126 | Intermediate Similarity | NPC12696 |
0.7126 | Intermediate Similarity | NPC36479 |
0.7111 | Intermediate Similarity | NPC100697 |
0.7083 | Intermediate Similarity | NPC177668 |
0.7079 | Intermediate Similarity | NPC3852 |
0.7053 | Intermediate Similarity | NPC248312 |
0.7053 | Intermediate Similarity | NPC309656 |
0.7045 | Intermediate Similarity | NPC236228 |
0.7045 | Intermediate Similarity | NPC256720 |
0.7021 | Intermediate Similarity | NPC477389 |
0.7021 | Intermediate Similarity | NPC477387 |
0.7 | Intermediate Similarity | NPC470684 |
0.7 | Intermediate Similarity | NPC470683 |
0.6947 | Remote Similarity | NPC477388 |
0.6947 | Remote Similarity | NPC477386 |
0.6915 | Remote Similarity | NPC298595 |
0.6915 | Remote Similarity | NPC290731 |
0.6907 | Remote Similarity | NPC159876 |
0.6889 | Remote Similarity | NPC137345 |
0.6889 | Remote Similarity | NPC181838 |
0.6869 | Remote Similarity | NPC256368 |
0.6867 | Remote Similarity | NPC250836 |
0.6854 | Remote Similarity | NPC170148 |
0.6854 | Remote Similarity | NPC329626 |
0.6848 | Remote Similarity | NPC118116 |
0.6842 | Remote Similarity | NPC470836 |
0.6837 | Remote Similarity | NPC302584 |
0.6837 | Remote Similarity | NPC276298 |
0.6837 | Remote Similarity | NPC210268 |
0.6832 | Remote Similarity | NPC475332 |
0.6832 | Remote Similarity | NPC26307 |
0.6809 | Remote Similarity | NPC166279 |
0.6804 | Remote Similarity | NPC473058 |
0.6804 | Remote Similarity | NPC299527 |
0.6771 | Remote Similarity | NPC189777 |
0.6768 | Remote Similarity | NPC91654 |
0.6768 | Remote Similarity | NPC280390 |
0.6768 | Remote Similarity | NPC98193 |
0.6768 | Remote Similarity | NPC67398 |
0.6768 | Remote Similarity | NPC119379 |
0.6768 | Remote Similarity | NPC474792 |
0.6744 | Remote Similarity | NPC472947 |
0.6735 | Remote Similarity | NPC478003 |
0.6735 | Remote Similarity | NPC158388 |
0.6735 | Remote Similarity | NPC3952 |
0.6735 | Remote Similarity | NPC478004 |
0.6703 | Remote Similarity | NPC68119 |
0.6703 | Remote Similarity | NPC13823 |
0.6702 | Remote Similarity | NPC239308 |
0.67 | Remote Similarity | NPC72817 |
0.67 | Remote Similarity | NPC178949 |
0.67 | Remote Similarity | NPC96736 |
0.67 | Remote Similarity | NPC477927 |
0.6699 | Remote Similarity | NPC473790 |
0.6699 | Remote Similarity | NPC469870 |
0.6699 | Remote Similarity | NPC469871 |
0.6667 | Remote Similarity | NPC311163 |
0.6667 | Remote Similarity | NPC208839 |
0.6667 | Remote Similarity | NPC471200 |
0.6667 | Remote Similarity | NPC476217 |
0.6667 | Remote Similarity | NPC313668 |
0.6667 | Remote Similarity | NPC16090 |
0.6667 | Remote Similarity | NPC315836 |
0.6667 | Remote Similarity | NPC197736 |
0.6667 | Remote Similarity | NPC473453 |
0.6667 | Remote Similarity | NPC475701 |
0.6667 | Remote Similarity | NPC184463 |
0.6667 | Remote Similarity | NPC243728 |
0.6667 | Remote Similarity | NPC470041 |
0.6667 | Remote Similarity | NPC473890 |
0.6634 | Remote Similarity | NPC230347 |
0.6634 | Remote Similarity | NPC286612 |
0.6634 | Remote Similarity | NPC275310 |
0.6633 | Remote Similarity | NPC115607 |
0.6633 | Remote Similarity | NPC22918 |
0.6633 | Remote Similarity | NPC97103 |
0.6632 | Remote Similarity | NPC319238 |
0.6632 | Remote Similarity | NPC83702 |
0.6632 | Remote Similarity | NPC259296 |
0.6632 | Remote Similarity | NPC98276 |
0.6629 | Remote Similarity | NPC190859 |
0.6629 | Remote Similarity | NPC471525 |
0.6628 | Remote Similarity | NPC305698 |
0.6628 | Remote Similarity | NPC473294 |
0.6628 | Remote Similarity | NPC471472 |
0.6604 | Remote Similarity | NPC221562 |
0.6604 | Remote Similarity | NPC474464 |
0.6604 | Remote Similarity | NPC231271 |
0.6604 | Remote Similarity | NPC470885 |
0.6604 | Remote Similarity | NPC470519 |
0.6604 | Remote Similarity | NPC187400 |
0.6602 | Remote Similarity | NPC476895 |
0.6602 | Remote Similarity | NPC158088 |
0.6602 | Remote Similarity | NPC216260 |
0.6602 | Remote Similarity | NPC309493 |
0.6602 | Remote Similarity | NPC470068 |
0.6602 | Remote Similarity | NPC5358 |
0.66 | Remote Similarity | NPC61275 |
0.6571 | Remote Similarity | NPC136816 |
0.6571 | Remote Similarity | NPC272015 |
0.6569 | Remote Similarity | NPC103165 |
0.6569 | Remote Similarity | NPC207617 |
0.6569 | Remote Similarity | NPC210717 |
0.6569 | Remote Similarity | NPC90583 |
0.6566 | Remote Similarity | NPC191323 |
0.6562 | Remote Similarity | NPC471379 |
0.6562 | Remote Similarity | NPC477747 |
0.6562 | Remote Similarity | NPC471494 |
0.6562 | Remote Similarity | NPC477746 |
0.6562 | Remote Similarity | NPC51267 |
0.6562 | Remote Similarity | NPC196911 |
0.6559 | Remote Similarity | NPC472948 |
0.6552 | Remote Similarity | NPC74722 |
0.6552 | Remote Similarity | NPC304690 |
0.6545 | Remote Similarity | NPC126897 |
0.6545 | Remote Similarity | NPC297945 |
0.6542 | Remote Similarity | NPC309448 |
0.6542 | Remote Similarity | NPC474015 |
0.6542 | Remote Similarity | NPC181845 |
0.6542 | Remote Similarity | NPC474569 |
0.6538 | Remote Similarity | NPC469942 |
0.6538 | Remote Similarity | NPC64348 |
0.6538 | Remote Similarity | NPC471242 |
0.6538 | Remote Similarity | NPC282669 |
0.6535 | Remote Similarity | NPC305160 |
0.6535 | Remote Similarity | NPC71589 |
0.6531 | Remote Similarity | NPC476704 |
0.6531 | Remote Similarity | NPC476707 |
0.6531 | Remote Similarity | NPC476708 |
0.6531 | Remote Similarity | NPC148534 |
0.6531 | Remote Similarity | NPC476706 |
0.6531 | Remote Similarity | NPC228415 |
0.6531 | Remote Similarity | NPC87189 |
0.6526 | Remote Similarity | NPC231601 |
0.6526 | Remote Similarity | NPC185949 |
0.6526 | Remote Similarity | NPC320548 |
0.6526 | Remote Similarity | NPC107498 |
0.6517 | Remote Similarity | NPC55652 |
0.6517 | Remote Similarity | NPC143576 |
0.6514 | Remote Similarity | NPC42482 |
0.6514 | Remote Similarity | NPC40440 |
0.6512 | Remote Similarity | NPC259299 |
0.6512 | Remote Similarity | NPC73603 |
0.6509 | Remote Similarity | NPC114874 |
0.6509 | Remote Similarity | NPC31907 |
0.6509 | Remote Similarity | NPC286969 |
0.6509 | Remote Similarity | NPC16520 |
0.6509 | Remote Similarity | NPC472252 |
0.6509 | Remote Similarity | NPC120123 |
0.6509 | Remote Similarity | NPC189852 |
0.6509 | Remote Similarity | NPC473020 |
0.6509 | Remote Similarity | NPC131479 |
0.6509 | Remote Similarity | NPC155010 |
0.6509 | Remote Similarity | NPC245280 |
0.6509 | Remote Similarity | NPC157659 |
0.6509 | Remote Similarity | NPC213190 |
0.6509 | Remote Similarity | NPC8039 |
0.6509 | Remote Similarity | NPC211879 |
0.6505 | Remote Similarity | NPC474994 |
0.6505 | Remote Similarity | NPC34732 |
0.6505 | Remote Similarity | NPC91197 |
0.6505 | Remote Similarity | NPC125551 |
0.6505 | Remote Similarity | NPC261807 |
0.6505 | Remote Similarity | NPC476021 |
0.6505 | Remote Similarity | NPC278506 |
0.6505 | Remote Similarity | NPC316604 |
0.6505 | Remote Similarity | NPC309503 |
0.6505 | Remote Similarity | NPC96597 |
0.6505 | Remote Similarity | NPC155319 |
0.6505 | Remote Similarity | NPC476040 |
0.6505 | Remote Similarity | NPC92231 |
0.6505 | Remote Similarity | NPC239547 |
0.6505 | Remote Similarity | NPC476893 |
0.65 | Remote Similarity | NPC146852 |
0.65 | Remote Similarity | NPC30515 |
0.6489 | Remote Similarity | NPC77003 |
0.6489 | Remote Similarity | NPC474894 |
0.6484 | Remote Similarity | NPC476606 |
0.6484 | Remote Similarity | NPC274079 |
0.6484 | Remote Similarity | NPC477925 |
0.6481 | Remote Similarity | NPC226642 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC247826 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 |
---|---|---|---|
0.6771 | Remote Similarity | NPD7524 | Approved |
0.6632 | Remote Similarity | NPD7338 | Clinical (unspecified phase) |
0.6545 | Remote Similarity | NPD8413 | Clinical (unspecified phase) |
0.6526 | Remote Similarity | NPD6695 | Phase 3 |
0.64 | Remote Similarity | NPD6698 | Approved |
0.64 | Remote Similarity | NPD46 | Approved |
0.6373 | Remote Similarity | NPD5282 | Discontinued |
0.6304 | Remote Similarity | NPD6933 | Approved |
0.6263 | Remote Similarity | NPD7750 | Discontinued |
0.6263 | Remote Similarity | NPD4251 | Approved |
0.6263 | Remote Similarity | NPD4250 | Approved |
0.6238 | Remote Similarity | NPD7838 | Discovery |
0.6211 | Remote Similarity | NPD6930 | Phase 2 |
0.6211 | Remote Similarity | NPD6931 | Approved |
0.6162 | Remote Similarity | NPD4249 | Approved |
0.6132 | Remote Similarity | NPD8029 | Clinical (unspecified phase) |
0.6105 | Remote Similarity | NPD6929 | Approved |
0.6087 | Remote Similarity | NPD6926 | Approved |
0.6087 | Remote Similarity | NPD6924 | Approved |
0.6064 | Remote Similarity | NPD6932 | Approved |
0.6042 | Remote Similarity | NPD7525 | Registered |
0.6036 | Remote Similarity | NPD6412 | Phase 2 |
0.6019 | Remote Similarity | NPD7983 | Approved |
0.6019 | Remote Similarity | NPD5344 | Discontinued |
0.6019 | Remote Similarity | NPD7087 | Discontinued |
0.5982 | Remote Similarity | NPD6686 | Approved |
0.5938 | Remote Similarity | NPD6683 | Phase 2 |
0.5922 | Remote Similarity | NPD3168 | Discontinued |
0.5917 | Remote Similarity | NPD8513 | Phase 3 |
0.5917 | Remote Similarity | NPD7503 | Approved |
0.5913 | Remote Similarity | NPD6053 | Discontinued |
0.59 | Remote Similarity | NPD6893 | Approved |
0.5895 | Remote Similarity | NPD6925 | Approved |
0.5895 | Remote Similarity | NPD5776 | Phase 2 |
0.5876 | Remote Similarity | NPD7514 | Phase 3 |
0.5876 | Remote Similarity | NPD7509 | Discontinued |
0.5876 | Remote Similarity | NPD7332 | Phase 2 |
0.5859 | Remote Similarity | NPD7154 | Phase 3 |
0.5851 | Remote Similarity | NPD7339 | Approved |
0.5851 | Remote Similarity | NPD6942 | Approved |
0.5833 | Remote Similarity | NPD7145 | Approved |
0.5825 | Remote Similarity | NPD5764 | Clinical (unspecified phase) |
0.5825 | Remote Similarity | NPD6101 | Approved |
0.5816 | Remote Similarity | NPD6898 | Phase 1 |
0.5795 | Remote Similarity | NPD371 | Approved |
0.5789 | Remote Similarity | NPD3701 | Clinical (unspecified phase) |
0.5785 | Remote Similarity | NPD8515 | Approved |
0.5785 | Remote Similarity | NPD8033 | Approved |
0.5785 | Remote Similarity | NPD8517 | Approved |
0.5785 | Remote Similarity | NPD8516 | Approved |
0.5773 | Remote Similarity | NPD7645 | Phase 2 |
0.5752 | Remote Similarity | NPD7899 | Clinical (unspecified phase) |
0.5714 | Remote Similarity | NPD4819 | Approved |
0.5714 | Remote Similarity | NPD4821 | Approved |
0.5714 | Remote Similarity | NPD4820 | Approved |
0.5714 | Remote Similarity | NPD6411 | Approved |
0.5714 | Remote Similarity | NPD8137 | Clinical (unspecified phase) |
0.5714 | Remote Similarity | NPD5790 | Clinical (unspecified phase) |
0.5714 | Remote Similarity | NPD4822 | Approved |
0.5702 | Remote Similarity | NPD8377 | Approved |
0.5702 | Remote Similarity | NPD8294 | Approved |
0.57 | Remote Similarity | NPD6110 | Phase 1 |
0.5688 | Remote Similarity | NPD4225 | Approved |
0.5676 | Remote Similarity | NPD7632 | Discontinued |
0.5667 | Remote Similarity | NPD7328 | Approved |
0.5667 | Remote Similarity | NPD7327 | Approved |
0.566 | Remote Similarity | NPD5778 | Approved |
0.566 | Remote Similarity | NPD5779 | Approved |
0.5657 | Remote Similarity | NPD6902 | Approved |
0.5656 | Remote Similarity | NPD8296 | Approved |
0.5656 | Remote Similarity | NPD8380 | Approved |
0.5656 | Remote Similarity | NPD8379 | Approved |
0.5656 | Remote Similarity | NPD8378 | Approved |
0.5656 | Remote Similarity | NPD8335 | Approved |
0.5652 | Remote Similarity | NPD6923 | Approved |
0.5652 | Remote Similarity | NPD6922 | Approved |
0.5636 | Remote Similarity | NPD6648 | Approved |
0.5631 | Remote Similarity | NPD4751 | Clinical (unspecified phase) |
0.562 | Remote Similarity | NPD7516 | Approved |
0.5603 | Remote Similarity | NPD6371 | Approved |
0.56 | Remote Similarity | NPD6435 | Approved |
PubChem CID   | 53377236 |
ChEMBL   | CHEMBL1806661 |
ZINC   |
Molecular Weight:   | 602.28 |
ALogP:   | 0.144 |
MLogP:   | 3.88 |
XLogP:   | 4.471 |
# Rotatable Bonds:   | 19 |
Polar Surface Area:   | 97.61 |
# H-Bond Aceptor:   | 7 |
# H-Bond Donor:   | 3 |
# Rings:   | 4 |
# Heavy Atoms:   | 38 |