Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO8424 | Juniperus foetidissima | Species | Cupressaceae | Eukaryota | UNPD* | |||
NPO4982 | Notholirion bulbuliferum | Species | Liliaceae | Eukaryota | UNPD* | |||
NPO298 | Isatdis radix | NA | NA | NA | TCMSP* | |||
NPO28985 | Radix bupleuri | Species | Lymnaeidae | Eukaryota | TCMSP* | |||
NPO1797 | Homo sapiens | Species | Hominidae | Eukaryota | Faeces |
PMID[18052033] |
||
NPO1797 | Homo sapiens | Species | Hominidae | Eukaryota | saliva |
PMID[12097436] |
||
NPO20338 | Mus musculus | Species | Muridae | Eukaryota |
PMID[19425150] |
|||
NPO10608 | Exodermis poria | NA | NA | NA | TCMID* | |||
NPO8413 | Echinus auritus | Species | Echinidae | Eukaryota | UNPD* | |||
NPO23815 | Isolona campanulata | Species | Annonaceae | Eukaryota | UNPD* | |||
NPO11409 | Trichothecium sympodiale | Species | NA | Eukaryota | UNPD* | |||
NPO13209 | Strychnos tomentosa | Species | Loganiaceae | Eukaryota | UNPD* | |||
NPO24555 | Coleogyne ramosissima | Species | Rosaceae | Eukaryota | UNPD* | |||
NPO23907 | Grazielia serrata | Species | Asteraceae | Eukaryota | UNPD* | |||
NPO7657 | Plectranthus ornatus | Species | Lamiaceae | Eukaryota | UNPD* | |||
NPO5743 | Salvia miltiorrhiza | Species | Lamiaceae | Eukaryota | UNPD* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT520 | Cell Line | 3T3-L1 | Mus musculus | Activity | = | 34 | Bq | 16640344 |
NPT2681 | Individual Protein | Glycogen phosphorylase, muscle form | Oryctolagus cuniculus | Ki | = | 1700000 | nM | 19781947 |
NPT2681 | Individual Protein | Glycogen phosphorylase, muscle form | Oryctolagus cuniculus | Ki | = | 1700000 | nM | 20430629 |
NPT2681 | Individual Protein | Glycogen phosphorylase, muscle form | Oryctolagus cuniculus | Ki | = | 1700000 | nM | 21821421 |
NPT2681 | Individual Protein | Glycogen phosphorylase, muscle form | Oryctolagus cuniculus | Ki | = | 1700000 | nM | 22770609 |
NPT2 | Others | Unspecified | Ki | = | 1700000 | nM | 10.1007/s00044-013-0812-0 | |
NPT3783 | Individual Protein | Muscle glycogen phosphorylase | Homo sapiens | Ki | = | 1700000 | nM | 25092521 |
NPT1667 | Individual Protein | Liver glycogen phosphorylase | Homo sapiens | Ki | = | 4900000 | nM | 25092521 |
NPT2 | Others | Unspecified | Ki | = | 1700000 | nM | 10.1039/C4MD00335G |
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 NPC92246 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 | NPC255377 |
1.0 | High Similarity | NPC69445 |
1.0 | High Similarity | NPC21209 |
1.0 | High Similarity | NPC176017 |
1.0 | High Similarity | NPC289758 |
1.0 | High Similarity | NPC73906 |
1.0 | High Similarity | NPC199857 |
1.0 | High Similarity | NPC285364 |
1.0 | High Similarity | NPC165846 |
0.9767 | High Similarity | NPC321087 |
0.9767 | High Similarity | NPC277475 |
0.9545 | High Similarity | NPC14144 |
0.9524 | High Similarity | NPC70756 |
0.9524 | High Similarity | NPC320240 |
0.9333 | High Similarity | NPC42503 |
0.9333 | High Similarity | NPC157193 |
0.9333 | High Similarity | NPC282143 |
0.9333 | High Similarity | NPC299781 |
0.9286 | High Similarity | NPC317182 |
0.9286 | High Similarity | NPC213159 |
0.9286 | High Similarity | NPC291502 |
0.9286 | High Similarity | NPC134252 |
0.9286 | High Similarity | NPC298699 |
0.9286 | High Similarity | NPC86191 |
0.913 | High Similarity | NPC323574 |
0.8936 | High Similarity | NPC23134 |
0.8936 | High Similarity | NPC326533 |
0.8936 | High Similarity | NPC124963 |
0.8936 | High Similarity | NPC233726 |
0.881 | High Similarity | NPC266553 |
0.8636 | High Similarity | NPC29721 |
0.8571 | High Similarity | NPC89145 |
0.8571 | High Similarity | NPC67660 |
0.8571 | High Similarity | NPC242073 |
0.8571 | High Similarity | NPC314821 |
0.8571 | High Similarity | NPC130683 |
0.8571 | High Similarity | NPC323361 |
0.8571 | High Similarity | NPC246558 |
0.8571 | High Similarity | NPC165198 |
0.8571 | High Similarity | NPC145112 |
0.8571 | High Similarity | NPC107914 |
0.8571 | High Similarity | NPC157514 |
0.8571 | High Similarity | NPC58629 |
0.8571 | High Similarity | NPC317501 |
0.8571 | High Similarity | NPC317626 |
0.8571 | High Similarity | NPC269166 |
0.8409 | Intermediate Similarity | NPC320189 |
0.84 | Intermediate Similarity | NPC303727 |
0.8085 | Intermediate Similarity | NPC252918 |
0.8085 | Intermediate Similarity | NPC230789 |
0.8077 | Intermediate Similarity | NPC148424 |
0.7925 | Intermediate Similarity | NPC472025 |
0.7925 | Intermediate Similarity | NPC219040 |
0.7778 | Intermediate Similarity | NPC320032 |
0.7778 | Intermediate Similarity | NPC290179 |
0.7778 | Intermediate Similarity | NPC322855 |
0.7778 | Intermediate Similarity | NPC34877 |
0.7778 | Intermediate Similarity | NPC317023 |
0.7755 | Intermediate Similarity | NPC82512 |
0.7636 | Intermediate Similarity | NPC143326 |
0.7619 | Intermediate Similarity | NPC86412 |
0.7619 | Intermediate Similarity | NPC293908 |
0.7619 | Intermediate Similarity | NPC192065 |
0.7619 | Intermediate Similarity | NPC325034 |
0.7619 | Intermediate Similarity | NPC66052 |
0.75 | Intermediate Similarity | NPC477763 |
0.75 | Intermediate Similarity | NPC472026 |
0.75 | Intermediate Similarity | NPC477750 |
0.75 | Intermediate Similarity | NPC477762 |
0.75 | Intermediate Similarity | NPC477753 |
0.75 | Intermediate Similarity | NPC477755 |
0.75 | Intermediate Similarity | NPC155457 |
0.75 | Intermediate Similarity | NPC477757 |
0.7451 | Intermediate Similarity | NPC329095 |
0.7347 | Intermediate Similarity | NPC88638 |
0.7308 | Intermediate Similarity | NPC103672 |
0.7308 | Intermediate Similarity | NPC320043 |
0.7292 | Intermediate Similarity | NPC207656 |
0.7292 | Intermediate Similarity | NPC107091 |
0.7255 | Intermediate Similarity | NPC329128 |
0.7255 | Intermediate Similarity | NPC322158 |
0.7241 | Intermediate Similarity | NPC277570 |
0.7241 | Intermediate Similarity | NPC258690 |
0.7241 | Intermediate Similarity | NPC268243 |
0.7241 | Intermediate Similarity | NPC317651 |
0.7241 | Intermediate Similarity | NPC325773 |
0.7174 | Intermediate Similarity | NPC99573 |
0.7174 | Intermediate Similarity | NPC227707 |
0.7174 | Intermediate Similarity | NPC88278 |
0.7174 | Intermediate Similarity | NPC102981 |
0.7174 | Intermediate Similarity | NPC111882 |
0.7119 | Intermediate Similarity | NPC13143 |
0.7119 | Intermediate Similarity | NPC6848 |
0.7119 | Intermediate Similarity | NPC31496 |
0.7119 | Intermediate Similarity | NPC294813 |
0.7 | Intermediate Similarity | NPC147292 |
0.7 | Intermediate Similarity | NPC76881 |
0.7 | Intermediate Similarity | NPC12040 |
0.7 | Intermediate Similarity | NPC471760 |
0.7 | Intermediate Similarity | NPC471761 |
0.7 | Intermediate Similarity | NPC190418 |
0.6905 | Remote Similarity | NPC149070 |
0.6905 | Remote Similarity | NPC197207 |
0.6905 | Remote Similarity | NPC127074 |
0.6905 | Remote Similarity | NPC187058 |
0.6905 | Remote Similarity | NPC182541 |
0.6885 | Remote Similarity | NPC129100 |
0.6885 | Remote Similarity | NPC291650 |
0.6885 | Remote Similarity | NPC477752 |
0.6885 | Remote Similarity | NPC322801 |
0.6885 | Remote Similarity | NPC477751 |
0.6885 | Remote Similarity | NPC477756 |
0.6885 | Remote Similarity | NPC477764 |
0.6863 | Remote Similarity | NPC112363 |
0.6774 | Remote Similarity | NPC477761 |
0.6774 | Remote Similarity | NPC477754 |
0.6774 | Remote Similarity | NPC206601 |
0.6774 | Remote Similarity | NPC477758 |
0.6774 | Remote Similarity | NPC32148 |
0.6774 | Remote Similarity | NPC477759 |
0.6774 | Remote Similarity | NPC477760 |
0.6667 | Remote Similarity | NPC67099 |
0.6667 | Remote Similarity | NPC50228 |
0.6667 | Remote Similarity | NPC97736 |
0.6667 | Remote Similarity | NPC250619 |
0.6667 | Remote Similarity | NPC220922 |
0.6591 | Remote Similarity | NPC227267 |
0.6562 | Remote Similarity | NPC223174 |
0.6562 | Remote Similarity | NPC241265 |
0.6562 | Remote Similarity | NPC327753 |
0.6562 | Remote Similarity | NPC211428 |
0.6562 | Remote Similarity | NPC327486 |
0.6562 | Remote Similarity | NPC285003 |
0.6462 | Remote Similarity | NPC474078 |
0.6462 | Remote Similarity | NPC53760 |
0.6462 | Remote Similarity | NPC471879 |
0.6462 | Remote Similarity | NPC52268 |
0.6364 | Remote Similarity | NPC185419 |
0.6364 | Remote Similarity | NPC184550 |
0.6346 | Remote Similarity | NPC314613 |
0.6304 | Remote Similarity | NPC313405 |
0.6269 | Remote Similarity | NPC308096 |
0.6269 | Remote Similarity | NPC225748 |
0.6269 | Remote Similarity | NPC248427 |
0.6269 | Remote Similarity | NPC132938 |
0.6269 | Remote Similarity | NPC9763 |
0.6269 | Remote Similarity | NPC291228 |
0.6269 | Remote Similarity | NPC163812 |
0.6269 | Remote Similarity | NPC169085 |
0.6269 | Remote Similarity | NPC39266 |
0.6269 | Remote Similarity | NPC206823 |
0.625 | Remote Similarity | NPC179823 |
0.619 | Remote Similarity | NPC33415 |
0.619 | Remote Similarity | NPC301586 |
0.6176 | Remote Similarity | NPC308489 |
0.6176 | Remote Similarity | NPC166250 |
0.6176 | Remote Similarity | NPC472173 |
0.6176 | Remote Similarity | NPC472174 |
0.6111 | Remote Similarity | NPC325822 |
0.6111 | Remote Similarity | NPC61270 |
0.6102 | Remote Similarity | NPC293692 |
0.6034 | Remote Similarity | NPC326557 |
0.6029 | Remote Similarity | NPC470659 |
0.6029 | Remote Similarity | NPC470660 |
0.6029 | Remote Similarity | NPC55652 |
0.6 | Remote Similarity | NPC326661 |
0.6 | Remote Similarity | NPC279575 |
0.6 | Remote Similarity | NPC229655 |
0.6 | Remote Similarity | NPC477350 |
0.6 | Remote Similarity | NPC182903 |
0.5962 | Remote Similarity | NPC62014 |
0.5952 | Remote Similarity | NPC320326 |
0.5926 | Remote Similarity | NPC247546 |
0.5926 | Remote Similarity | NPC172086 |
0.5915 | Remote Similarity | NPC216883 |
0.5915 | Remote Similarity | NPC110813 |
0.5915 | Remote Similarity | NPC188793 |
0.5915 | Remote Similarity | NPC476782 |
0.5915 | Remote Similarity | NPC314772 |
0.5915 | Remote Similarity | NPC314968 |
0.5915 | Remote Similarity | NPC476783 |
0.5915 | Remote Similarity | NPC476781 |
0.5902 | Remote Similarity | NPC174485 |
0.5862 | Remote Similarity | NPC289979 |
0.5833 | Remote Similarity | NPC477330 |
0.5833 | Remote Similarity | NPC133377 |
0.5833 | Remote Similarity | NPC477329 |
0.5833 | Remote Similarity | NPC281563 |
0.5833 | Remote Similarity | NPC477328 |
0.5833 | Remote Similarity | NPC475425 |
0.5833 | Remote Similarity | NPC98750 |
0.5833 | Remote Similarity | NPC109887 |
0.5833 | Remote Similarity | NPC477325 |
0.5833 | Remote Similarity | NPC146380 |
0.5833 | Remote Similarity | NPC477323 |
0.5833 | Remote Similarity | NPC177343 |
0.5833 | Remote Similarity | NPC150557 |
0.5833 | Remote Similarity | NPC477320 |
0.5833 | Remote Similarity | NPC272841 |
0.5833 | Remote Similarity | NPC477326 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC92246 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 | NPD8993 | Phase 1 |
1.0 | High Similarity | NPD8998 | Phase 2 |
1.0 | High Similarity | NPD8997 | Approved |
1.0 | High Similarity | NPD9000 | Phase 3 |
1.0 | High Similarity | NPD8999 | Phase 3 |
0.9545 | High Similarity | NPD8965 | Approved |
0.9545 | High Similarity | NPD8966 | Approved |
0.9286 | High Similarity | NPD8788 | Approved |
0.8936 | High Similarity | NPD905 | Approved |
0.8936 | High Similarity | NPD904 | Phase 3 |
0.8636 | High Similarity | NPD9006 | Approved |
0.8571 | High Similarity | NPD9036 | Phase 3 |
0.8571 | High Similarity | NPD889 | Approved |
0.8571 | High Similarity | NPD893 | Approved |
0.8571 | High Similarity | NPD892 | Phase 3 |
0.8571 | High Similarity | NPD887 | Approved |
0.8571 | High Similarity | NPD891 | Phase 3 |
0.8571 | High Similarity | NPD9035 | Clinical (unspecified phase) |
0.8571 | High Similarity | NPD888 | Phase 3 |
0.8571 | High Similarity | NPD890 | Clinical (unspecified phase) |
0.8571 | High Similarity | NPD895 | Approved |
0.8571 | High Similarity | NPD894 | Approved |
0.8367 | Intermediate Similarity | NPD2269 | Approved |
0.7872 | Intermediate Similarity | NPD8994 | Approved |
0.7619 | Intermediate Similarity | NPD9053 | Approved |
0.7619 | Intermediate Similarity | NPD9052 | Approved |
0.7619 | Intermediate Similarity | NPD9051 | Approved |
0.7609 | Intermediate Similarity | NPD8957 | Approved |
0.75 | Intermediate Similarity | NPD6123 | Approved |
0.7407 | Intermediate Similarity | NPD2267 | Suspended |
0.7308 | Intermediate Similarity | NPD9049 | Discontinued |
0.7308 | Intermediate Similarity | NPD9050 | Approved |
0.7292 | Intermediate Similarity | NPD9218 | Clinical (unspecified phase) |
0.7292 | Intermediate Similarity | NPD9219 | Approved |
0.7241 | Intermediate Similarity | NPD847 | Phase 1 |
0.7241 | Intermediate Similarity | NPD8961 | Approved |
0.7234 | Intermediate Similarity | NPD8958 | Phase 2 |
0.7174 | Intermediate Similarity | NPD8996 | Phase 3 |
0.7174 | Intermediate Similarity | NPD8995 | Clinical (unspecified phase) |
0.6964 | Remote Similarity | NPD369 | Approved |
0.6905 | Remote Similarity | NPD8814 | Phase 3 |
0.6885 | Remote Similarity | NPD9031 | Approved |
0.6885 | Remote Similarity | NPD9033 | Approved |
0.6885 | Remote Similarity | NPD9032 | Approved |
0.6885 | Remote Similarity | NPD9030 | Approved |
0.6863 | Remote Similarity | NPD9139 | Approved |
0.6774 | Remote Similarity | NPD897 | Approved |
0.6774 | Remote Similarity | NPD898 | Approved |
0.6774 | Remote Similarity | NPD896 | Approved |
0.6727 | Remote Similarity | NPD7346 | Approved |
0.6667 | Remote Similarity | NPD8959 | Approved |
0.6562 | Remote Similarity | NPD9445 | Approved |
0.6557 | Remote Similarity | NPD1457 | Discontinued |
0.6327 | Remote Similarity | NPD8967 | Approved |
0.6269 | Remote Similarity | NPD67 | Phase 2 |
0.6269 | Remote Similarity | NPD389 | Phase 3 |
0.6269 | Remote Similarity | NPD9034 | Approved |
0.6269 | Remote Similarity | NPD3181 | Approved |
0.619 | Remote Similarity | NPD8549 | Clinical (unspecified phase) |
0.6111 | Remote Similarity | NPD9061 | Clinical (unspecified phase) |
0.6042 | Remote Similarity | NPD8976 | Approved |
0.6042 | Remote Similarity | NPD8977 | Phase 3 |
0.6034 | Remote Similarity | NPD884 | Clinical (unspecified phase) |
0.6034 | Remote Similarity | NPD885 | Approved |
0.6 | Remote Similarity | NPD372 | Clinical (unspecified phase) |
0.5926 | Remote Similarity | NPD9005 | Phase 3 |
0.5926 | Remote Similarity | NPD9004 | Approved |
0.5926 | Remote Similarity | NPD9003 | Clinical (unspecified phase) |
0.5915 | Remote Similarity | NPD9434 | Approved |
0.5915 | Remote Similarity | NPD9435 | Approved |
0.5893 | Remote Similarity | NPD1399 | Approved |
0.5893 | Remote Similarity | NPD1400 | Approved |
0.5814 | Remote Similarity | NPD8988 | Clinical (unspecified phase) |
0.5789 | Remote Similarity | NPD66 | Approved |
0.5789 | Remote Similarity | NPD9008 | Approved |
0.5789 | Remote Similarity | NPD9007 | Approved |
0.5789 | Remote Similarity | NPD65 | Approved |
0.5789 | Remote Similarity | NPD64 | Approved |
0.5789 | Remote Similarity | NPD72 | Approved |
0.5789 | Remote Similarity | NPD9009 | Approved |
0.5789 | Remote Similarity | NPD8960 | Approved |
0.5789 | Remote Similarity | NPD9011 | Approved |
0.5789 | Remote Similarity | NPD9010 | Approved |
0.5753 | Remote Similarity | NPD7329 | Approved |
0.5735 | Remote Similarity | NPD7532 | Clinical (unspecified phase) |
0.566 | Remote Similarity | NPD9110 | Approved |
0.5614 | Remote Similarity | NPD9002 | Approved |
0.5614 | Remote Similarity | NPD9001 | Clinical (unspecified phase) |
PubChem CID   | 79025 |
ChEMBL   | CHEMBL423707 |
ZINC   |
Molecular Weight:   | 180.06 |
ALogP:   | -2.5134 |
MLogP:   | 1.46 |
XLogP:   | -1.697 |
# Rotatable Bonds:   | 6 |
Polar Surface Area:   | 110.38 |
# H-Bond Aceptor:   | 6 |
# H-Bond Donor:   | 5 |
# Rings:   | 1 |
# Heavy Atoms:   | 12 |