Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO1797 | Homo sapiens | Species | Hominidae | Eukaryota |
PMID[18492944] |
|||
NPO1797 | Homo sapiens | Species | Hominidae | Eukaryota | saliva |
PMID[22308371] |
||
NPO1797 | Homo sapiens | Species | Hominidae | Eukaryota | blood |
PMID[17659063] |
||
NPO21581 | Polygala arillata | Species | Polygalaceae | Eukaryota | TCM_Taiwan* | |||
NPO27260 | Polygala tenuifolia | Species | Polygalaceae | Eukaryota | TCM_Taiwan* | |||
NPO28210 | Myrmecia gulosa | Species | Formicidae | Eukaryota | UNPD* | |||
NPO28028 | Aquilegia atrata | Species | Ranunculaceae | Eukaryota | UNPD* | |||
NPO27846 | Aeodes ulvoidea | Species | Halymeniaceae | Eukaryota | UNPD* | |||
NPO27622 | Ligularia cyathiceps | Species | Asteraceae | Eukaryota | UNPD* | |||
NPO28154 | Acrodontium salmoneum | Species | Mycosphaerellaceae | Eukaryota | UNPD* | |||
NPO17149 | Heracleum candicans | Species | Apiaceae | Eukaryota | UNPD* | |||
NPO28261 | Pyrophorus pellucens | Species | Elateridae | Eukaryota | UNPD* | |||
NPO28081 | Actinoplanes arizonaensis | Species | Micromonosporaceae | Bacteria | UNPD* | |||
NPO27934 | Mezilaurus synandra | Species | Lauraceae | Eukaryota | UNPD* | |||
NPO20099 | Petalostylis labicheoides | Species | Fabaceae | Eukaryota | UNPD* | |||
NPO27808 | Cremanthodium discoideum | Species | Asteraceae | Eukaryota | UNPD* | |||
NPO21068 | Centaurea sulphurea | Species | Asteraceae | Eukaryota | UNPD* | |||
NPO28476 | Doris tricolor | Species | Dorididae | Eukaryota | UNPD* | |||
NPO28102 | Baccharis tucumanensis | Species | Asteraceae | Eukaryota | UNPD* | |||
NPO20441 | Glaucium flavum | Species | Papaveraceae | Eukaryota | UNPD* | |||
NPO28521 | Delphinium vestitum | Species | Ranunculaceae | Eukaryota | UNPD* | |||
NPO298 | Isatdis radix | NA | NA | NA | TCMSP* | |||
NPO19588 | Piper coruscans | Species | Piperaceae | Eukaryota | UNPD* | |||
NPO21485 | Polygala sibirica | Species | Polygalaceae | Eukaryota | TM-MC* | |||
NPO27081 | Clavularia inflata | Species | Clavulariidae | Eukaryota | UNPD* | |||
NPO27260 | Polygala tenuifolia | Species | Polygalaceae | Eukaryota | TM-MC* | |||
NPO28312 | Lentinus squarrosulus | Species | Lentinaceae | Eukaryota | UNPD* | |||
NPO4969 | Sesbania bispinosa | Species | Fabaceae | Eukaryota | UNPD* | |||
NPO28295 | Foeniculum vulgare | Species | Apiaceae | Eukaryota | UNPD* | |||
NPO29361 | Chondrus yendoi | Species | Gigartinaceae | Eukaryota | UNPD* | |||
NPO3513 | Fuscoporia senex | Species | Hymenochaetaceae | Eukaryota | UNPD* | |||
NPO8672 | Ophiura ophiura | Species | Ophiuridae | Eukaryota | UNPD* | |||
NPO19599 | Pogostemon parviflorus | Species | Lamiaceae | Eukaryota | UNPD* | |||
NPO28491 | Astrotrichilia voamatata | Species | Meliaceae | Eukaryota | UNPD* | |||
NPO1797 | Homo sapiens | Species | Hominidae | Eukaryota | cerebrospinal fluid | Geigy Scientific Tables, 8th Rev edition. Edited by C. Lentner, West Cadwell, N.J.: Medical education Div., Ciba-Geigy Corp., Basel, Switzerland c1981-1992. |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT5618 | Individual Protein | Beta-glucosidase | Prunus avium | Ki | = | 60000000 | nM | 10.1016/S0960-894X(01)81044-1 |
NPT5114 | Individual Protein | Beta-galactosidase | Escherichia coli | Ki | = | 71000000 | nM | 10.1016/S0960-894X(01)81044-1 |
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 NPC266553 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 |
---|---|---|
0.925 | High Similarity | NPC70756 |
0.925 | High Similarity | NPC320240 |
0.881 | High Similarity | NPC289758 |
0.881 | High Similarity | NPC73906 |
0.881 | High Similarity | NPC165846 |
0.881 | High Similarity | NPC199857 |
0.881 | High Similarity | NPC255377 |
0.881 | High Similarity | NPC285364 |
0.881 | High Similarity | NPC21209 |
0.881 | High Similarity | NPC69445 |
0.881 | High Similarity | NPC92246 |
0.881 | High Similarity | NPC176017 |
0.8649 | High Similarity | NPC293908 |
0.8649 | High Similarity | NPC325034 |
0.8649 | High Similarity | NPC192065 |
0.8649 | High Similarity | NPC86412 |
0.8649 | High Similarity | NPC66052 |
0.8605 | High Similarity | NPC321087 |
0.8605 | High Similarity | NPC277475 |
0.8409 | Intermediate Similarity | NPC14144 |
0.8333 | Intermediate Similarity | NPC29721 |
0.8222 | Intermediate Similarity | NPC157193 |
0.8222 | Intermediate Similarity | NPC282143 |
0.8222 | Intermediate Similarity | NPC299781 |
0.8222 | Intermediate Similarity | NPC42503 |
0.8182 | Intermediate Similarity | NPC88638 |
0.814 | Intermediate Similarity | NPC207656 |
0.814 | Intermediate Similarity | NPC107091 |
0.8095 | Intermediate Similarity | NPC86191 |
0.8095 | Intermediate Similarity | NPC298699 |
0.8095 | Intermediate Similarity | NPC291502 |
0.8095 | Intermediate Similarity | NPC213159 |
0.8095 | Intermediate Similarity | NPC317182 |
0.8095 | Intermediate Similarity | NPC134252 |
0.8049 | Intermediate Similarity | NPC227707 |
0.8049 | Intermediate Similarity | NPC99573 |
0.8049 | Intermediate Similarity | NPC102981 |
0.8049 | Intermediate Similarity | NPC111882 |
0.8049 | Intermediate Similarity | NPC88278 |
0.8043 | Intermediate Similarity | NPC323574 |
0.7872 | Intermediate Similarity | NPC326533 |
0.7872 | Intermediate Similarity | NPC23134 |
0.7872 | Intermediate Similarity | NPC233726 |
0.7872 | Intermediate Similarity | NPC124963 |
0.7838 | Intermediate Similarity | NPC197207 |
0.7838 | Intermediate Similarity | NPC127074 |
0.7838 | Intermediate Similarity | NPC182541 |
0.7838 | Intermediate Similarity | NPC187058 |
0.7838 | Intermediate Similarity | NPC149070 |
0.7778 | Intermediate Similarity | NPC230789 |
0.7778 | Intermediate Similarity | NPC252918 |
0.7609 | Intermediate Similarity | NPC112363 |
0.7551 | Intermediate Similarity | NPC317626 |
0.7551 | Intermediate Similarity | NPC314821 |
0.7551 | Intermediate Similarity | NPC58629 |
0.7551 | Intermediate Similarity | NPC165198 |
0.7551 | Intermediate Similarity | NPC242073 |
0.7551 | Intermediate Similarity | NPC107914 |
0.7551 | Intermediate Similarity | NPC317501 |
0.7551 | Intermediate Similarity | NPC269166 |
0.7551 | Intermediate Similarity | NPC89145 |
0.7551 | Intermediate Similarity | NPC323361 |
0.7551 | Intermediate Similarity | NPC246558 |
0.7551 | Intermediate Similarity | NPC157514 |
0.7551 | Intermediate Similarity | NPC67660 |
0.7551 | Intermediate Similarity | NPC130683 |
0.7551 | Intermediate Similarity | NPC145112 |
0.7447 | Intermediate Similarity | NPC82512 |
0.7436 | Intermediate Similarity | NPC227267 |
0.74 | Intermediate Similarity | NPC303727 |
0.7273 | Intermediate Similarity | NPC320189 |
0.7143 | Intermediate Similarity | NPC329095 |
0.7115 | Intermediate Similarity | NPC148424 |
0.7027 | Intermediate Similarity | NPC33415 |
0.7027 | Intermediate Similarity | NPC301586 |
0.7021 | Intermediate Similarity | NPC314613 |
0.7 | Intermediate Similarity | NPC103672 |
0.7 | Intermediate Similarity | NPC320043 |
0.6981 | Remote Similarity | NPC220922 |
0.6981 | Remote Similarity | NPC472025 |
0.6981 | Remote Similarity | NPC219040 |
0.6852 | Remote Similarity | NPC320032 |
0.6852 | Remote Similarity | NPC290179 |
0.6852 | Remote Similarity | NPC317023 |
0.6852 | Remote Similarity | NPC322855 |
0.6852 | Remote Similarity | NPC34877 |
0.6757 | Remote Similarity | NPC320326 |
0.6735 | Remote Similarity | NPC61270 |
0.6735 | Remote Similarity | NPC325822 |
0.6727 | Remote Similarity | NPC143326 |
0.6607 | Remote Similarity | NPC472026 |
0.6607 | Remote Similarity | NPC477757 |
0.6607 | Remote Similarity | NPC477755 |
0.6607 | Remote Similarity | NPC477763 |
0.6607 | Remote Similarity | NPC155457 |
0.6607 | Remote Similarity | NPC477753 |
0.6607 | Remote Similarity | NPC477750 |
0.6607 | Remote Similarity | NPC477762 |
0.6596 | Remote Similarity | NPC62014 |
0.6579 | Remote Similarity | NPC325345 |
0.6545 | Remote Similarity | NPC182903 |
0.6531 | Remote Similarity | NPC247546 |
0.6531 | Remote Similarity | NPC172086 |
0.6429 | Remote Similarity | NPC174485 |
0.6379 | Remote Similarity | NPC277570 |
0.6379 | Remote Similarity | NPC268243 |
0.6379 | Remote Similarity | NPC317651 |
0.6379 | Remote Similarity | NPC258690 |
0.6379 | Remote Similarity | NPC325773 |
0.6364 | Remote Similarity | NPC293692 |
0.6346 | Remote Similarity | NPC322803 |
0.6346 | Remote Similarity | NPC278465 |
0.6346 | Remote Similarity | NPC321102 |
0.6346 | Remote Similarity | NPC325153 |
0.6327 | Remote Similarity | NPC8597 |
0.6316 | Remote Similarity | NPC272307 |
0.6275 | Remote Similarity | NPC329128 |
0.6275 | Remote Similarity | NPC322158 |
0.6271 | Remote Similarity | NPC13143 |
0.6271 | Remote Similarity | NPC6848 |
0.6271 | Remote Similarity | NPC294813 |
0.6271 | Remote Similarity | NPC31496 |
0.625 | Remote Similarity | NPC85078 |
0.625 | Remote Similarity | NPC476209 |
0.6216 | Remote Similarity | NPC213764 |
0.617 | Remote Similarity | NPC228782 |
0.617 | Remote Similarity | NPC313565 |
0.617 | Remote Similarity | NPC259982 |
0.6167 | Remote Similarity | NPC190418 |
0.6167 | Remote Similarity | NPC471761 |
0.6167 | Remote Similarity | NPC12040 |
0.6167 | Remote Similarity | NPC471760 |
0.6167 | Remote Similarity | NPC76881 |
0.6167 | Remote Similarity | NPC147292 |
0.6111 | Remote Similarity | NPC289979 |
0.6087 | Remote Similarity | NPC152008 |
0.6078 | Remote Similarity | NPC46254 |
0.6071 | Remote Similarity | NPC322148 |
0.6066 | Remote Similarity | NPC477752 |
0.6066 | Remote Similarity | NPC477756 |
0.6066 | Remote Similarity | NPC129100 |
0.6066 | Remote Similarity | NPC477764 |
0.6066 | Remote Similarity | NPC291650 |
0.6066 | Remote Similarity | NPC477751 |
0.6066 | Remote Similarity | NPC322801 |
0.6053 | Remote Similarity | NPC128335 |
0.6053 | Remote Similarity | NPC560 |
0.6038 | Remote Similarity | NPC277878 |
0.6038 | Remote Similarity | NPC476136 |
0.6038 | Remote Similarity | NPC476149 |
0.6038 | Remote Similarity | NPC244869 |
0.6038 | Remote Similarity | NPC300235 |
0.6034 | Remote Similarity | NPC475412 |
0.6 | Remote Similarity | NPC197039 |
0.6 | Remote Similarity | NPC110884 |
0.5968 | Remote Similarity | NPC206601 |
0.5968 | Remote Similarity | NPC477761 |
0.5968 | Remote Similarity | NPC179823 |
0.5968 | Remote Similarity | NPC477754 |
0.5968 | Remote Similarity | NPC477758 |
0.5968 | Remote Similarity | NPC477760 |
0.5968 | Remote Similarity | NPC32148 |
0.5968 | Remote Similarity | NPC477759 |
0.5965 | Remote Similarity | NPC170172 |
0.5946 | Remote Similarity | NPC157340 |
0.5946 | Remote Similarity | NPC199270 |
0.5932 | Remote Similarity | NPC172622 |
0.5926 | Remote Similarity | NPC196612 |
0.5909 | Remote Similarity | NPC313405 |
0.5873 | Remote Similarity | NPC250619 |
0.5873 | Remote Similarity | NPC67099 |
0.5873 | Remote Similarity | NPC97736 |
0.5873 | Remote Similarity | NPC50228 |
0.5818 | Remote Similarity | NPC320588 |
0.5818 | Remote Similarity | NPC23155 |
0.5818 | Remote Similarity | NPC53463 |
0.5818 | Remote Similarity | NPC469937 |
0.5818 | Remote Similarity | NPC327257 |
0.5789 | Remote Similarity | NPC88887 |
0.5789 | Remote Similarity | NPC140389 |
0.5789 | Remote Similarity | NPC232554 |
0.5789 | Remote Similarity | NPC275462 |
0.5789 | Remote Similarity | NPC304786 |
0.5781 | Remote Similarity | NPC241265 |
0.5781 | Remote Similarity | NPC285003 |
0.5781 | Remote Similarity | NPC327486 |
0.5781 | Remote Similarity | NPC327753 |
0.5781 | Remote Similarity | NPC223174 |
0.5781 | Remote Similarity | NPC211428 |
0.575 | Remote Similarity | NPC238135 |
0.575 | Remote Similarity | NPC159845 |
0.5738 | Remote Similarity | NPC476702 |
0.5714 | Remote Similarity | NPC267243 |
0.5714 | Remote Similarity | NPC326557 |
0.5714 | Remote Similarity | NPC122962 |
0.5692 | Remote Similarity | NPC471879 |
0.5692 | Remote Similarity | NPC320012 |
0.5692 | Remote Similarity | NPC52268 |
0.5692 | Remote Similarity | NPC53760 |
0.5692 | Remote Similarity | NPC474078 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC266553 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 |
---|---|---|---|
0.881 | High Similarity | NPD8994 | Approved |
0.881 | High Similarity | NPD8997 | Approved |
0.881 | High Similarity | NPD8993 | Phase 1 |
0.881 | High Similarity | NPD8999 | Phase 3 |
0.881 | High Similarity | NPD9000 | Phase 3 |
0.881 | High Similarity | NPD8998 | Phase 2 |
0.8649 | High Similarity | NPD9051 | Approved |
0.8649 | High Similarity | NPD9052 | Approved |
0.8649 | High Similarity | NPD9053 | Approved |
0.8537 | High Similarity | NPD8957 | Approved |
0.8409 | Intermediate Similarity | NPD8965 | Approved |
0.8409 | Intermediate Similarity | NPD8966 | Approved |
0.8333 | Intermediate Similarity | NPD9006 | Approved |
0.814 | Intermediate Similarity | NPD9219 | Approved |
0.814 | Intermediate Similarity | NPD9218 | Clinical (unspecified phase) |
0.8095 | Intermediate Similarity | NPD8958 | Phase 2 |
0.8095 | Intermediate Similarity | NPD8788 | Approved |
0.8049 | Intermediate Similarity | NPD8996 | Phase 3 |
0.8049 | Intermediate Similarity | NPD8995 | Clinical (unspecified phase) |
0.7872 | Intermediate Similarity | NPD905 | Approved |
0.7872 | Intermediate Similarity | NPD904 | Phase 3 |
0.7838 | Intermediate Similarity | NPD8814 | Phase 3 |
0.7609 | Intermediate Similarity | NPD9139 | Approved |
0.7551 | Intermediate Similarity | NPD890 | Clinical (unspecified phase) |
0.7551 | Intermediate Similarity | NPD892 | Phase 3 |
0.7551 | Intermediate Similarity | NPD891 | Phase 3 |
0.7551 | Intermediate Similarity | NPD9035 | Clinical (unspecified phase) |
0.7551 | Intermediate Similarity | NPD895 | Approved |
0.7551 | Intermediate Similarity | NPD887 | Approved |
0.7551 | Intermediate Similarity | NPD888 | Phase 3 |
0.7551 | Intermediate Similarity | NPD9036 | Phase 3 |
0.7551 | Intermediate Similarity | NPD893 | Approved |
0.7551 | Intermediate Similarity | NPD889 | Approved |
0.7551 | Intermediate Similarity | NPD894 | Approved |
0.7347 | Intermediate Similarity | NPD2269 | Approved |
0.7027 | Intermediate Similarity | NPD8549 | Clinical (unspecified phase) |
0.7 | Intermediate Similarity | NPD9049 | Discontinued |
0.7 | Intermediate Similarity | NPD9050 | Approved |
0.6981 | Remote Similarity | NPD8959 | Approved |
0.6744 | Remote Similarity | NPD8976 | Approved |
0.6744 | Remote Similarity | NPD8977 | Phase 3 |
0.6735 | Remote Similarity | NPD9061 | Clinical (unspecified phase) |
0.6607 | Remote Similarity | NPD6123 | Approved |
0.6579 | Remote Similarity | NPD8988 | Clinical (unspecified phase) |
0.6531 | Remote Similarity | NPD9004 | Approved |
0.6531 | Remote Similarity | NPD9005 | Phase 3 |
0.6531 | Remote Similarity | NPD9003 | Clinical (unspecified phase) |
0.6481 | Remote Similarity | NPD2267 | Suspended |
0.6379 | Remote Similarity | NPD847 | Phase 1 |
0.6379 | Remote Similarity | NPD8961 | Approved |
0.625 | Remote Similarity | NPD9110 | Approved |
0.6154 | Remote Similarity | NPD9002 | Approved |
0.6154 | Remote Similarity | NPD1399 | Approved |
0.6154 | Remote Similarity | NPD9001 | Clinical (unspecified phase) |
0.6154 | Remote Similarity | NPD1400 | Approved |
0.6087 | Remote Similarity | NPD7536 | Approved |
0.6071 | Remote Similarity | NPD369 | Approved |
0.6066 | Remote Similarity | NPD9032 | Approved |
0.6066 | Remote Similarity | NPD9031 | Approved |
0.6066 | Remote Similarity | NPD9030 | Approved |
0.6066 | Remote Similarity | NPD9033 | Approved |
0.6038 | Remote Similarity | NPD8960 | Approved |
0.6038 | Remote Similarity | NPD9008 | Approved |
0.6038 | Remote Similarity | NPD9009 | Approved |
0.6038 | Remote Similarity | NPD9010 | Approved |
0.6038 | Remote Similarity | NPD64 | Approved |
0.6038 | Remote Similarity | NPD66 | Approved |
0.6038 | Remote Similarity | NPD72 | Approved |
0.6038 | Remote Similarity | NPD9011 | Approved |
0.6038 | Remote Similarity | NPD65 | Approved |
0.6038 | Remote Similarity | NPD9007 | Approved |
0.6 | Remote Similarity | NPD371 | Approved |
0.5968 | Remote Similarity | NPD898 | Approved |
0.5968 | Remote Similarity | NPD897 | Approved |
0.5968 | Remote Similarity | NPD896 | Approved |
0.5946 | Remote Similarity | NPD8226 | Approved |
0.5862 | Remote Similarity | NPD9455 | Approved |
0.5818 | Remote Similarity | NPD3728 | Approved |
0.5818 | Remote Similarity | NPD3730 | Approved |
0.5818 | Remote Similarity | NPD7346 | Approved |
0.5781 | Remote Similarity | NPD9445 | Approved |
0.5769 | Remote Similarity | NPD8964 | Approved |
0.5763 | Remote Similarity | NPD393 | Approved |
0.5738 | Remote Similarity | NPD1457 | Discontinued |
0.5714 | Remote Similarity | NPD885 | Approved |
0.5714 | Remote Similarity | NPD884 | Clinical (unspecified phase) |
0.5667 | Remote Similarity | NPD9027 | Phase 3 |
0.5667 | Remote Similarity | NPD9026 | Phase 2 |
0.5667 | Remote Similarity | NPD9029 | Phase 3 |
0.5667 | Remote Similarity | NPD9028 | Phase 2 |
0.5614 | Remote Similarity | NPD73 | Approved |
PubChem CID   | 64960 |
ChEMBL   | CHEMBL344637 |
ZINC   |
Molecular Weight:   | 164.07 |
ALogP:   | -2.1737 |
MLogP:   | 1.57 |
XLogP:   | -1.591 |
# Rotatable Bonds:   | 5 |
Polar Surface Area:   | 90.15 |
# H-Bond Aceptor:   | 5 |
# H-Bond Donor:   | 4 |
# Rings:   | 1 |
# Heavy Atoms:   | 11 |