Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT81 | Cell Line | A549 | Homo sapiens | LC50 | = | 100 | nM | 10096871 |
NPT111 | Cell Line | K562 | Homo sapiens | LC50 | = | 120 | nM | 18443129 |
NPT2890 | Protein Complex | Sodium/potassium-transporting ATPase | Homo sapiens | IC50 | > | 100000 | nM | Open TG-GATES in vivo data: Hematology |
NPT2 | Others | Unspecified | IC50 | > | 100000 | nM | 19258270 | |
NPT2 | Others | Unspecified | IC50 | > | 100000 | nM | 18710917 |
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 NPC68293 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 | NPC262845 |
0.8729 | High Similarity | NPC82759 |
0.824 | Intermediate Similarity | NPC290261 |
0.7872 | Intermediate Similarity | NPC80738 |
0.768 | Intermediate Similarity | NPC136922 |
0.697 | Remote Similarity | NPC470276 |
0.6855 | Remote Similarity | NPC169365 |
0.6855 | Remote Similarity | NPC197447 |
0.6822 | Remote Similarity | NPC181298 |
0.6822 | Remote Similarity | NPC238850 |
0.6806 | Remote Similarity | NPC476558 |
0.6803 | Remote Similarity | NPC473153 |
0.6767 | Remote Similarity | NPC476190 |
0.6748 | Remote Similarity | NPC141401 |
0.6746 | Remote Similarity | NPC293299 |
0.6746 | Remote Similarity | NPC45365 |
0.6744 | Remote Similarity | NPC475274 |
0.6718 | Remote Similarity | NPC328074 |
0.6718 | Remote Similarity | NPC470025 |
0.6718 | Remote Similarity | NPC317460 |
0.6718 | Remote Similarity | NPC321272 |
0.6694 | Remote Similarity | NPC189651 |
0.6694 | Remote Similarity | NPC475098 |
0.6693 | Remote Similarity | NPC272632 |
0.6691 | Remote Similarity | NPC233500 |
0.6667 | Remote Similarity | NPC219656 |
0.6667 | Remote Similarity | NPC470027 |
0.6667 | Remote Similarity | NPC61717 |
0.6667 | Remote Similarity | NPC244380 |
0.6667 | Remote Similarity | NPC175614 |
0.6642 | Remote Similarity | NPC470275 |
0.6642 | Remote Similarity | NPC196130 |
0.6641 | Remote Similarity | NPC284162 |
0.6641 | Remote Similarity | NPC17791 |
0.6641 | Remote Similarity | NPC255401 |
0.664 | Remote Similarity | NPC227865 |
0.6617 | Remote Similarity | NPC475163 |
0.6617 | Remote Similarity | NPC216665 |
0.6617 | Remote Similarity | NPC43213 |
0.6615 | Remote Similarity | NPC257853 |
0.6615 | Remote Similarity | NPC475065 |
0.6596 | Remote Similarity | NPC134902 |
0.6594 | Remote Similarity | NPC219804 |
0.6593 | Remote Similarity | NPC473617 |
0.6593 | Remote Similarity | NPC311554 |
0.6593 | Remote Similarity | NPC476956 |
0.6593 | Remote Similarity | NPC257457 |
0.6593 | Remote Similarity | NPC473828 |
0.6589 | Remote Similarity | NPC475176 |
0.6583 | Remote Similarity | NPC210216 |
0.6579 | Remote Similarity | NPC298005 |
0.6579 | Remote Similarity | NPC36463 |
0.6577 | Remote Similarity | NPC298469 |
0.6577 | Remote Similarity | NPC284625 |
0.6577 | Remote Similarity | NPC69176 |
0.6567 | Remote Similarity | NPC470075 |
0.6567 | Remote Similarity | NPC172197 |
0.6567 | Remote Similarity | NPC274293 |
0.6565 | Remote Similarity | NPC316708 |
0.6565 | Remote Similarity | NPC328052 |
0.6565 | Remote Similarity | NPC122926 |
0.6565 | Remote Similarity | NPC113012 |
0.6562 | Remote Similarity | NPC475585 |
0.6562 | Remote Similarity | NPC474550 |
0.6562 | Remote Similarity | NPC473577 |
0.6557 | Remote Similarity | NPC53555 |
0.6555 | Remote Similarity | NPC473097 |
0.6549 | Remote Similarity | NPC254823 |
0.6547 | Remote Similarity | NPC145238 |
0.6547 | Remote Similarity | NPC3381 |
0.6544 | Remote Similarity | NPC473274 |
0.6544 | Remote Similarity | NPC473270 |
0.6538 | Remote Similarity | NPC473482 |
0.6538 | Remote Similarity | NPC88701 |
0.6538 | Remote Similarity | NPC475418 |
0.6538 | Remote Similarity | NPC318363 |
0.6535 | Remote Similarity | NPC114540 |
0.6535 | Remote Similarity | NPC32577 |
0.6535 | Remote Similarity | NPC155332 |
0.6533 | Remote Similarity | NPC214821 |
0.6533 | Remote Similarity | NPC298067 |
0.6532 | Remote Similarity | NPC190713 |
0.6532 | Remote Similarity | NPC16967 |
0.6531 | Remote Similarity | NPC180770 |
0.6531 | Remote Similarity | NPC302276 |
0.6522 | Remote Similarity | NPC469943 |
0.6519 | Remote Similarity | NPC271621 |
0.6519 | Remote Similarity | NPC59751 |
0.6519 | Remote Similarity | NPC471120 |
0.6519 | Remote Similarity | NPC471117 |
0.6519 | Remote Similarity | NPC27413 |
0.6519 | Remote Similarity | NPC471854 |
0.6515 | Remote Similarity | NPC475480 |
0.6515 | Remote Similarity | NPC470076 |
0.6515 | Remote Similarity | NPC471484 |
0.6515 | Remote Similarity | NPC262083 |
0.6515 | Remote Similarity | NPC475668 |
0.6515 | Remote Similarity | NPC470026 |
0.6515 | Remote Similarity | NPC473921 |
0.6512 | Remote Similarity | NPC266570 |
0.6512 | Remote Similarity | NPC475414 |
0.6512 | Remote Similarity | NPC475290 |
0.6512 | Remote Similarity | NPC173172 |
0.6508 | Remote Similarity | NPC266955 |
0.6508 | Remote Similarity | NPC290802 |
0.6508 | Remote Similarity | NPC473510 |
0.6508 | Remote Similarity | NPC230546 |
0.6507 | Remote Similarity | NPC246209 |
0.6503 | Remote Similarity | NPC139585 |
0.65 | Remote Similarity | NPC60765 |
0.6493 | Remote Similarity | NPC67259 |
0.6493 | Remote Similarity | NPC147912 |
0.6484 | Remote Similarity | NPC475334 |
0.6484 | Remote Similarity | NPC474124 |
0.6484 | Remote Similarity | NPC183570 |
0.6484 | Remote Similarity | NPC85742 |
0.6484 | Remote Similarity | NPC297617 |
0.6484 | Remote Similarity | NPC475623 |
0.6484 | Remote Similarity | NPC280566 |
0.6484 | Remote Similarity | NPC473694 |
0.648 | Remote Similarity | NPC202705 |
0.648 | Remote Similarity | NPC471815 |
0.6479 | Remote Similarity | NPC471407 |
0.6471 | Remote Similarity | NPC471121 |
0.6471 | Remote Similarity | NPC471118 |
0.6467 | Remote Similarity | NPC193579 |
0.6467 | Remote Similarity | NPC141669 |
0.6466 | Remote Similarity | NPC476269 |
0.6462 | Remote Similarity | NPC329048 |
0.6462 | Remote Similarity | NPC330011 |
0.6462 | Remote Similarity | NPC473284 |
0.6458 | Remote Similarity | NPC476097 |
0.6458 | Remote Similarity | NPC470427 |
0.6458 | Remote Similarity | NPC327664 |
0.6457 | Remote Similarity | NPC115899 |
0.6454 | Remote Similarity | NPC204556 |
0.6449 | Remote Similarity | NPC52839 |
0.6449 | Remote Similarity | NPC473256 |
0.6449 | Remote Similarity | NPC470878 |
0.6444 | Remote Similarity | NPC207637 |
0.6444 | Remote Similarity | NPC478216 |
0.6443 | Remote Similarity | NPC162910 |
0.6439 | Remote Similarity | NPC475563 |
0.6439 | Remote Similarity | NPC177047 |
0.6439 | Remote Similarity | NPC475134 |
0.6434 | Remote Similarity | NPC181104 |
0.6434 | Remote Similarity | NPC288502 |
0.6434 | Remote Similarity | NPC475331 |
0.6434 | Remote Similarity | NPC161775 |
0.6434 | Remote Similarity | NPC121518 |
0.6434 | Remote Similarity | NPC473543 |
0.6434 | Remote Similarity | NPC475335 |
0.6434 | Remote Similarity | NPC103298 |
0.6434 | Remote Similarity | NPC80809 |
0.6434 | Remote Similarity | NPC201144 |
0.6429 | Remote Similarity | NPC278386 |
0.6429 | Remote Similarity | NPC57079 |
0.6429 | Remote Similarity | NPC92275 |
0.6429 | Remote Similarity | NPC124512 |
0.6429 | Remote Similarity | NPC108368 |
0.6429 | Remote Similarity | NPC159763 |
0.6429 | Remote Similarity | NPC475653 |
0.6429 | Remote Similarity | NPC474440 |
0.6423 | Remote Similarity | NPC9674 |
0.6423 | Remote Similarity | NPC476529 |
0.6423 | Remote Similarity | NPC475775 |
0.6423 | Remote Similarity | NPC162615 |
0.6423 | Remote Similarity | NPC205034 |
0.6423 | Remote Similarity | NPC38232 |
0.6423 | Remote Similarity | NPC19028 |
0.6423 | Remote Similarity | NPC214697 |
0.6423 | Remote Similarity | NPC152778 |
0.6418 | Remote Similarity | NPC5485 |
0.6417 | Remote Similarity | NPC473891 |
0.6414 | Remote Similarity | NPC192334 |
0.6414 | Remote Similarity | NPC60150 |
0.6412 | Remote Similarity | NPC470024 |
0.6412 | Remote Similarity | NPC181994 |
0.6412 | Remote Similarity | NPC220155 |
0.6408 | Remote Similarity | NPC329919 |
0.6408 | Remote Similarity | NPC477793 |
0.6408 | Remote Similarity | NPC270109 |
0.6406 | Remote Similarity | NPC476471 |
0.6406 | Remote Similarity | NPC475344 |
0.6403 | Remote Similarity | NPC162009 |
0.6403 | Remote Similarity | NPC257017 |
0.6403 | Remote Similarity | NPC27335 |
0.64 | Remote Similarity | NPC88009 |
0.64 | Remote Similarity | NPC803 |
0.6397 | Remote Similarity | NPC286528 |
0.6397 | Remote Similarity | NPC20302 |
0.6397 | Remote Similarity | NPC140055 |
0.6397 | Remote Similarity | NPC185287 |
0.6397 | Remote Similarity | NPC167606 |
0.6393 | Remote Similarity | NPC182136 |
0.6393 | Remote Similarity | NPC310479 |
0.6391 | Remote Similarity | NPC474315 |
0.6391 | Remote Similarity | NPC29501 |
0.6389 | Remote Similarity | NPC473485 |
0.6389 | Remote Similarity | NPC476824 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC68293 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 |
---|---|---|---|
0.6641 | Remote Similarity | NPD6640 | Phase 3 |
0.6429 | Remote Similarity | NPD4225 | Approved |
0.6397 | Remote Similarity | NPD7115 | Discovery |
0.6391 | Remote Similarity | NPD7116 | Clinical (unspecified phase) |
0.6331 | Remote Similarity | NPD7503 | Approved |
0.6276 | Remote Similarity | NPD7260 | Phase 2 |
0.6234 | Remote Similarity | NPD7625 | Phase 1 |
0.6233 | Remote Similarity | NPD6845 | Suspended |
0.6214 | Remote Similarity | NPD8033 | Approved |
0.6187 | Remote Similarity | NPD7516 | Approved |
0.617 | Remote Similarity | NPD7623 | Phase 3 |
0.617 | Remote Similarity | NPD7624 | Clinical (unspecified phase) |
0.6148 | Remote Similarity | NPD7524 | Approved |
0.6143 | Remote Similarity | NPD8294 | Approved |
0.6143 | Remote Similarity | NPD8377 | Approved |
0.6124 | Remote Similarity | NPD7640 | Approved |
0.6124 | Remote Similarity | NPD7639 | Approved |
0.6115 | Remote Similarity | NPD7328 | Approved |
0.6115 | Remote Similarity | NPD7327 | Approved |
0.6111 | Remote Similarity | NPD7746 | Phase 1 |
0.6111 | Remote Similarity | NPD7747 | Phase 1 |
0.6103 | Remote Similarity | NPD8297 | Approved |
0.6099 | Remote Similarity | NPD8335 | Approved |
0.6099 | Remote Similarity | NPD8380 | Approved |
0.6099 | Remote Similarity | NPD8379 | Approved |
0.6099 | Remote Similarity | NPD8296 | Approved |
0.6099 | Remote Similarity | NPD7739 | Clinical (unspecified phase) |
0.6099 | Remote Similarity | NPD8378 | Approved |
0.6047 | Remote Similarity | NPD7638 | Approved |
0.6043 | Remote Similarity | NPD7505 | Discontinued |
0.6028 | Remote Similarity | NPD7299 | Clinical (unspecified phase) |
0.6 | Remote Similarity | NPD6404 | Discontinued |
0.5986 | Remote Similarity | NPD6909 | Approved |
0.5986 | Remote Similarity | NPD6908 | Approved |
0.5985 | Remote Similarity | NPD6882 | Approved |
0.5954 | Remote Similarity | NPD5344 | Discontinued |
0.5931 | Remote Similarity | NPD7507 | Approved |
0.5929 | Remote Similarity | NPD7500 | Approved |
0.5926 | Remote Similarity | NPD7320 | Approved |
0.5926 | Remote Similarity | NPD6686 | Approved |
0.5923 | Remote Similarity | NPD8029 | Clinical (unspecified phase) |
0.5921 | Remote Similarity | NPD6334 | Approved |
0.5921 | Remote Similarity | NPD6333 | Approved |
0.5915 | Remote Similarity | NPD6054 | Approved |
0.5906 | Remote Similarity | NPD5781 | Clinical (unspecified phase) |
0.5896 | Remote Similarity | NPD5357 | Phase 1 |
0.5894 | Remote Similarity | NPD8387 | Clinical (unspecified phase) |
0.589 | Remote Similarity | NPD8074 | Phase 3 |
0.5878 | Remote Similarity | NPD6648 | Approved |
0.5873 | Remote Similarity | NPD7838 | Discovery |
0.5839 | Remote Similarity | NPD6420 | Discontinued |
0.5839 | Remote Similarity | NPD6421 | Discontinued |
0.5839 | Remote Similarity | NPD6371 | Approved |
0.5833 | Remote Similarity | NPD6370 | Approved |
0.5828 | Remote Similarity | NPD8415 | Approved |
0.5827 | Remote Similarity | NPD7637 | Suspended |
0.582 | Remote Similarity | NPD6695 | Phase 3 |
0.5811 | Remote Similarity | NPD7319 | Approved |
0.5809 | Remote Similarity | NPD6899 | Approved |
0.5809 | Remote Similarity | NPD6881 | Approved |
0.5806 | Remote Similarity | NPD5279 | Phase 3 |
0.5804 | Remote Similarity | NPD6059 | Approved |
0.5797 | Remote Similarity | NPD6649 | Approved |
0.5797 | Remote Similarity | NPD8130 | Phase 1 |
0.5797 | Remote Similarity | NPD6650 | Approved |
0.5793 | Remote Similarity | NPD7604 | Phase 2 |
0.5789 | Remote Similarity | NPD5211 | Phase 2 |
0.5786 | Remote Similarity | NPD7274 | Clinical (unspecified phase) |
0.5782 | Remote Similarity | NPD7078 | Approved |
0.5778 | Remote Similarity | NPD7128 | Approved |
0.5778 | Remote Similarity | NPD6402 | Approved |
0.5778 | Remote Similarity | NPD6675 | Approved |
0.5778 | Remote Similarity | NPD5739 | Approved |
0.5772 | Remote Similarity | NPD6400 | Clinical (unspecified phase) |
0.5772 | Remote Similarity | NPD7338 | Clinical (unspecified phase) |
0.5772 | Remote Similarity | NPD6914 | Discontinued |
0.5769 | Remote Similarity | NPD5220 | Clinical (unspecified phase) |
0.5769 | Remote Similarity | NPD5222 | Approved |
0.5769 | Remote Similarity | NPD5221 | Approved |
0.5766 | Remote Similarity | NPD6373 | Approved |
0.5766 | Remote Similarity | NPD6372 | Approved |
0.5764 | Remote Similarity | NPD6016 | Approved |
0.5764 | Remote Similarity | NPD6015 | Approved |
0.5763 | Remote Similarity | NPD6933 | Approved |
0.576 | Remote Similarity | NPD7750 | Discontinued |
0.5753 | Remote Similarity | NPD7492 | Approved |
0.5743 | Remote Similarity | NPD7736 | Approved |
0.5735 | Remote Similarity | NPD5697 | Approved |
0.5735 | Remote Similarity | NPD7899 | Clinical (unspecified phase) |
0.5725 | Remote Similarity | NPD7102 | Approved |
0.5725 | Remote Similarity | NPD7290 | Approved |
0.5725 | Remote Similarity | NPD5173 | Approved |
0.5725 | Remote Similarity | NPD6883 | Approved |
0.5724 | Remote Similarity | NPD5988 | Approved |
0.5714 | Remote Similarity | NPD6616 | Approved |
0.5714 | Remote Similarity | NPD4632 | Approved |
0.5714 | Remote Similarity | NPD4159 | Approved |
0.5704 | Remote Similarity | NPD6009 | Approved |
0.5704 | Remote Similarity | NPD5141 | Approved |
0.5703 | Remote Similarity | NPD6079 | Approved |
0.5695 | Remote Similarity | NPD8338 | Approved |
0.5694 | Remote Similarity | NPD6319 | Approved |
0.5693 | Remote Similarity | NPD6011 | Approved |
0.5685 | Remote Similarity | NPD7829 | Approved |
0.5685 | Remote Similarity | NPD7830 | Approved |
0.5683 | Remote Similarity | NPD6847 | Approved |
0.5683 | Remote Similarity | NPD6869 | Approved |
0.5683 | Remote Similarity | NPD6617 | Approved |
0.5676 | Remote Similarity | NPD8293 | Discontinued |
0.5672 | Remote Similarity | NPD7632 | Discontinued |
0.5669 | Remote Similarity | NPD5328 | Approved |
0.5662 | Remote Similarity | NPD7333 | Discontinued |
0.5657 | Remote Similarity | NPD8470 | Clinical (unspecified phase) |
0.5652 | Remote Similarity | NPD6013 | Approved |
0.5652 | Remote Similarity | NPD6014 | Approved |
0.5652 | Remote Similarity | NPD6012 | Approved |
0.5649 | Remote Similarity | NPD4697 | Phase 3 |
0.5643 | Remote Similarity | NPD6053 | Discontinued |
0.5642 | Remote Similarity | NPD8407 | Phase 2 |
0.5639 | Remote Similarity | NPD4696 | Approved |
0.5639 | Remote Similarity | NPD5285 | Approved |
0.5639 | Remote Similarity | NPD5286 | Approved |
0.563 | Remote Similarity | NPD1407 | Approved |
0.5625 | Remote Similarity | NPD5785 | Approved |
0.5625 | Remote Similarity | NPD3168 | Discontinued |
0.562 | Remote Similarity | NPD5701 | Approved |
0.562 | Remote Similarity | NPD6929 | Approved |
0.562 | Remote Similarity | NPD6412 | Phase 2 |
0.5606 | Remote Similarity | NPD4755 | Approved |
0.5606 | Remote Similarity | NPD6083 | Phase 2 |
0.5606 | Remote Similarity | NPD6084 | Phase 2 |
0.5604 | Remote Similarity | NPD8360 | Approved |
0.5604 | Remote Similarity | NPD8361 | Approved |
PubChem CID   | 73355247 |
ChEMBL   | CHEMBL2419837 |
ZINC   |
Molecular Weight:   | 749.41 |
ALogP:   | 0.6286 |
MLogP:   | 4.98 |
XLogP:   | 5.518 |
# Rotatable Bonds:   | 24 |
Polar Surface Area:   | 186.34 |
# H-Bond Aceptor:   | 11 |
# H-Bond Donor:   | 6 |
# Rings:   | 6 |
# Heavy Atoms:   | 54 |