Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO26967 | Phallus impudicus | Species | Phallaceae | Eukaryota | TCMID* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT112 | Cell Line | MOLT-4 | Homo sapiens | IC50 | = | 59000 | nM | 18672367 |
NPT24 | Organism | Human immunodeficiency virus 1 | Human immunodeficiency virus 1 | IC50 | = | 29000 | nM | 18672367 |
NPT2 | Others | Unspecified | Ratio IC50 | = | 2 | 18672367 |
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 NPC152008 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 |
---|---|---|
0.9459 | High Similarity | NPC197039 |
0.7727 | Intermediate Similarity | NPC62014 |
0.7632 | Intermediate Similarity | NPC12231 |
0.7632 | Intermediate Similarity | NPC185538 |
0.7632 | Intermediate Similarity | NPC181516 |
0.7632 | Intermediate Similarity | NPC205141 |
0.7632 | Intermediate Similarity | NPC139131 |
0.7632 | Intermediate Similarity | NPC291158 |
0.7632 | Intermediate Similarity | NPC152759 |
0.7632 | Intermediate Similarity | NPC272998 |
0.75 | Intermediate Similarity | NPC474914 |
0.75 | Intermediate Similarity | NPC474392 |
0.7447 | Intermediate Similarity | NPC26253 |
0.7391 | Intermediate Similarity | NPC8597 |
0.7368 | Intermediate Similarity | NPC126915 |
0.7317 | Intermediate Similarity | NPC74352 |
0.725 | Intermediate Similarity | NPC97967 |
0.7105 | Intermediate Similarity | NPC163556 |
0.7105 | Intermediate Similarity | NPC112242 |
0.7105 | Intermediate Similarity | NPC147096 |
0.7105 | Intermediate Similarity | NPC185041 |
0.7105 | Intermediate Similarity | NPC24506 |
0.7105 | Intermediate Similarity | NPC225783 |
0.7105 | Intermediate Similarity | NPC236797 |
0.7059 | Intermediate Similarity | NPC53463 |
0.7059 | Intermediate Similarity | NPC23155 |
0.7059 | Intermediate Similarity | NPC289979 |
0.7059 | Intermediate Similarity | NPC469937 |
0.7059 | Intermediate Similarity | NPC320588 |
0.7027 | Intermediate Similarity | NPC238135 |
0.7 | Intermediate Similarity | NPC474120 |
0.7 | Intermediate Similarity | NPC474089 |
0.6905 | Remote Similarity | NPC128996 |
0.6792 | Remote Similarity | NPC148424 |
0.675 | Remote Similarity | NPC319034 |
0.675 | Remote Similarity | NPC72324 |
0.675 | Remote Similarity | NPC193062 |
0.675 | Remote Similarity | NPC66124 |
0.675 | Remote Similarity | NPC1748 |
0.6727 | Remote Similarity | NPC174485 |
0.6667 | Remote Similarity | NPC322148 |
0.6607 | Remote Similarity | NPC477757 |
0.6607 | Remote Similarity | NPC477755 |
0.6607 | Remote Similarity | NPC477763 |
0.6607 | Remote Similarity | NPC477762 |
0.6607 | Remote Similarity | NPC477753 |
0.6607 | Remote Similarity | NPC477750 |
0.6591 | Remote Similarity | NPC221022 |
0.6591 | Remote Similarity | NPC471282 |
0.6585 | Remote Similarity | NPC139569 |
0.6579 | Remote Similarity | NPC279895 |
0.65 | Remote Similarity | NPC122962 |
0.65 | Remote Similarity | NPC272426 |
0.65 | Remote Similarity | NPC267243 |
0.6486 | Remote Similarity | NPC317724 |
0.6486 | Remote Similarity | NPC329496 |
0.6486 | Remote Similarity | NPC128335 |
0.6486 | Remote Similarity | NPC230452 |
0.6458 | Remote Similarity | NPC30195 |
0.6458 | Remote Similarity | NPC12438 |
0.6429 | Remote Similarity | NPC470363 |
0.6429 | Remote Similarity | NPC474627 |
0.6429 | Remote Similarity | NPC328786 |
0.6429 | Remote Similarity | NPC86545 |
0.6429 | Remote Similarity | NPC223374 |
0.6429 | Remote Similarity | NPC196442 |
0.6429 | Remote Similarity | NPC201338 |
0.6429 | Remote Similarity | NPC301398 |
0.6364 | Remote Similarity | NPC472025 |
0.6275 | Remote Similarity | NPC55678 |
0.625 | Remote Similarity | NPC469781 |
0.6216 | Remote Similarity | NPC304786 |
0.62 | Remote Similarity | NPC106872 |
0.619 | Remote Similarity | NPC286498 |
0.617 | Remote Similarity | NPC203531 |
0.617 | Remote Similarity | NPC474126 |
0.617 | Remote Similarity | NPC236579 |
0.617 | Remote Similarity | NPC474125 |
0.6167 | Remote Similarity | NPC190418 |
0.6167 | Remote Similarity | NPC471761 |
0.6167 | Remote Similarity | NPC471760 |
0.6154 | Remote Similarity | NPC287811 |
0.6136 | Remote Similarity | NPC177022 |
0.6087 | Remote Similarity | NPC469759 |
0.6087 | Remote Similarity | NPC266553 |
0.6087 | Remote Similarity | NPC160261 |
0.6078 | Remote Similarity | NPC82512 |
0.6071 | Remote Similarity | NPC474577 |
0.6066 | Remote Similarity | NPC477752 |
0.6066 | Remote Similarity | NPC477756 |
0.6066 | Remote Similarity | NPC477751 |
0.6066 | Remote Similarity | NPC477764 |
0.6034 | Remote Similarity | NPC472026 |
0.6 | Remote Similarity | NPC319709 |
0.6 | Remote Similarity | NPC328497 |
0.6 | Remote Similarity | NPC289484 |
0.6 | Remote Similarity | NPC476702 |
0.6 | Remote Similarity | NPC110884 |
0.6 | Remote Similarity | NPC324004 |
0.5968 | Remote Similarity | NPC206601 |
0.5968 | Remote Similarity | NPC477761 |
0.5968 | Remote Similarity | NPC477754 |
0.5968 | Remote Similarity | NPC477758 |
0.5968 | Remote Similarity | NPC477760 |
0.5968 | Remote Similarity | NPC477759 |
0.5957 | Remote Similarity | NPC53541 |
0.5952 | Remote Similarity | NPC147054 |
0.5946 | Remote Similarity | NPC237965 |
0.5946 | Remote Similarity | NPC318912 |
0.5932 | Remote Similarity | NPC17455 |
0.5918 | Remote Similarity | NPC215358 |
0.5918 | Remote Similarity | NPC287231 |
0.5918 | Remote Similarity | NPC47363 |
0.5909 | Remote Similarity | NPC80641 |
0.5902 | Remote Similarity | NPC238646 |
0.5897 | Remote Similarity | NPC272307 |
0.5873 | Remote Similarity | NPC67099 |
0.5873 | Remote Similarity | NPC50228 |
0.5873 | Remote Similarity | NPC97736 |
0.5849 | Remote Similarity | NPC100096 |
0.5849 | Remote Similarity | NPC233726 |
0.5849 | Remote Similarity | NPC124963 |
0.5849 | Remote Similarity | NPC23134 |
0.5849 | Remote Similarity | NPC326533 |
0.5833 | Remote Similarity | NPC235788 |
0.5833 | Remote Similarity | NPC144829 |
0.5818 | Remote Similarity | NPC303727 |
0.5814 | Remote Similarity | NPC227267 |
0.5814 | Remote Similarity | NPC283682 |
0.58 | Remote Similarity | NPC473914 |
0.58 | Remote Similarity | NPC76976 |
0.5789 | Remote Similarity | NPC275462 |
0.5789 | Remote Similarity | NPC213764 |
0.5781 | Remote Similarity | NPC285003 |
0.5781 | Remote Similarity | NPC241265 |
0.5781 | Remote Similarity | NPC211428 |
0.575 | Remote Similarity | NPC223195 |
0.575 | Remote Similarity | NPC159845 |
0.5745 | Remote Similarity | NPC149299 |
0.5745 | Remote Similarity | NPC256163 |
0.5745 | Remote Similarity | NPC250028 |
0.5745 | Remote Similarity | NPC161097 |
0.5745 | Remote Similarity | NPC40597 |
0.5745 | Remote Similarity | NPC28598 |
0.5745 | Remote Similarity | NPC12156 |
0.5745 | Remote Similarity | NPC165533 |
0.5714 | Remote Similarity | NPC22101 |
0.5714 | Remote Similarity | NPC469925 |
0.5714 | Remote Similarity | NPC104537 |
0.5714 | Remote Similarity | NPC271921 |
0.5714 | Remote Similarity | NPC127091 |
0.5714 | Remote Similarity | NPC148192 |
0.5714 | Remote Similarity | NPC40965 |
0.5714 | Remote Similarity | NPC70756 |
0.5714 | Remote Similarity | NPC330426 |
0.5714 | Remote Similarity | NPC320240 |
0.5714 | Remote Similarity | NPC473829 |
0.5714 | Remote Similarity | NPC29721 |
0.5714 | Remote Similarity | NPC76051 |
0.5714 | Remote Similarity | NPC475443 |
0.5714 | Remote Similarity | NPC286842 |
0.5692 | Remote Similarity | NPC470268 |
0.5692 | Remote Similarity | NPC321873 |
0.5692 | Remote Similarity | NPC52268 |
0.5692 | Remote Similarity | NPC53760 |
0.569 | Remote Similarity | NPC290179 |
0.569 | Remote Similarity | NPC34877 |
0.569 | Remote Similarity | NPC317023 |
0.5686 | Remote Similarity | NPC230789 |
0.5686 | Remote Similarity | NPC277475 |
0.5686 | Remote Similarity | NPC252918 |
0.5686 | Remote Similarity | NPC249754 |
0.5686 | Remote Similarity | NPC321087 |
0.5682 | Remote Similarity | NPC325034 |
0.5682 | Remote Similarity | NPC66052 |
0.5682 | Remote Similarity | NPC192065 |
0.5682 | Remote Similarity | NPC293908 |
0.5682 | Remote Similarity | NPC86412 |
0.5667 | Remote Similarity | NPC172622 |
0.566 | Remote Similarity | NPC90904 |
0.5652 | Remote Similarity | NPC469714 |
0.5652 | Remote Similarity | NPC473568 |
0.5652 | Remote Similarity | NPC469712 |
0.5645 | Remote Similarity | NPC474402 |
0.5636 | Remote Similarity | NPC269166 |
0.5636 | Remote Similarity | NPC58629 |
0.5636 | Remote Similarity | NPC145112 |
0.5636 | Remote Similarity | NPC130683 |
0.5636 | Remote Similarity | NPC157514 |
0.5636 | Remote Similarity | NPC246558 |
0.5636 | Remote Similarity | NPC242073 |
0.5636 | Remote Similarity | NPC67660 |
0.5636 | Remote Similarity | NPC323361 |
0.5636 | Remote Similarity | NPC165198 |
0.5636 | Remote Similarity | NPC107914 |
0.5636 | Remote Similarity | NPC89145 |
0.5625 | Remote Similarity | NPC196924 |
0.5625 | Remote Similarity | NPC141481 |
0.5625 | Remote Similarity | NPC307783 |
0.5625 | Remote Similarity | NPC82315 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC152008 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 |
---|---|---|---|
1.0 | High Similarity | NPD7536 | Approved |
0.7632 | Intermediate Similarity | NPD5383 | Approved |
0.7632 | Intermediate Similarity | NPD2272 | Approved |
0.7059 | Intermediate Similarity | NPD3730 | Approved |
0.7059 | Intermediate Similarity | NPD3728 | Approved |
0.65 | Remote Similarity | NPD907 | Approved |
0.65 | Remote Similarity | NPD1461 | Approved |
0.65 | Remote Similarity | NPD908 | Approved |
0.6346 | Remote Similarity | NPD2269 | Approved |
0.6222 | Remote Similarity | NPD5799 | Discontinued |
0.62 | Remote Similarity | NPD6125 | Clinical (unspecified phase) |
0.6182 | Remote Similarity | NPD2267 | Suspended |
0.6 | Remote Similarity | NPD3211 | Approved |
0.5918 | Remote Similarity | NPD2699 | Approved |
0.5849 | Remote Similarity | NPD905 | Approved |
0.5849 | Remote Similarity | NPD904 | Phase 3 |
0.5833 | Remote Similarity | NPD8957 | Approved |
0.5714 | Remote Similarity | NPD9006 | Approved |
0.5714 | Remote Similarity | NPD6950 | Discontinued |
0.5692 | Remote Similarity | NPD7532 | Clinical (unspecified phase) |
0.5682 | Remote Similarity | NPD9053 | Approved |
0.5682 | Remote Similarity | NPD9051 | Approved |
0.5682 | Remote Similarity | NPD9052 | Approved |
0.5636 | Remote Similarity | NPD893 | Approved |
0.5636 | Remote Similarity | NPD890 | Clinical (unspecified phase) |
0.5636 | Remote Similarity | NPD889 | Approved |
0.5636 | Remote Similarity | NPD888 | Phase 3 |
0.5636 | Remote Similarity | NPD895 | Approved |
0.5636 | Remote Similarity | NPD887 | Approved |
0.5636 | Remote Similarity | NPD891 | Phase 3 |
0.5636 | Remote Similarity | NPD892 | Phase 3 |
0.5636 | Remote Similarity | NPD894 | Approved |
0.5625 | Remote Similarity | NPD2270 | Approved |
0.56 | Remote Similarity | NPD9218 | Clinical (unspecified phase) |
0.56 | Remote Similarity | NPD9219 | Approved |
PubChem CID   | 123921 |
ChEMBL   | CHEMBL501722 |
ZINC   |
Molecular Weight:   | 538.41 |
ALogP:   | -4.3246 |
MLogP:   | 3.55 |
XLogP:   | 3.883 |
# Rotatable Bonds:   | 36 |
Polar Surface Area:   | 94.07 |
# H-Bond Aceptor:   | 9 |
# H-Bond Donor:   | 1 |
# Rings:   | 0 |
# Heavy Atoms:   | 37 |