Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO29613 | Cyperi rhizoma | NA | NA | NA | TCMSP* | |||
NPO29141 | Panax ginseng | Species | Araliaceae | Eukaryota | TCMSP* | |||
NPO12536 | Flemingia prostrata roxb | Species | Fabaceae | Eukaryota | TCMSP* | |||
NPO14121 | Panax ginseng | Species | Araliaceae | Eukaryota | TCMSP* | |||
NPO25682 | Acorus calamus | Species | Acoraceae | Eukaryota | TM-MC* | |||
NPO5681 | Acorus gramineus | Species | Acoraceae | Eukaryota | TM-MC* | |||
NPO8666 | Acorus tatarinowii | Species | Acoraceae | Eukaryota | TM-MC* | |||
NPO163 | Daucus carota | Species | Apiaceae | Eukaryota | TM-MC* | |||
NPO4391 | Hypericum perforatum | Species | Hypericaceae | Eukaryota | TM-MC* | |||
NPO21072 | Rhododendron dauricum | Species | Ericaceae | Eukaryota | TM-MC* | |||
NPO9721 | Radix moghaniae philippinensis | Species | Lymnaeidae | Eukaryota | TCMID* | |||
NPO17333 | Valeriana officinalis | Species | Caprifoliaceae | Eukaryota | TCMID* | |||
NPO24373 | Lobelia inflata | Species | Campanulaceae | Eukaryota | TCMID* | |||
NPO13515 | Succinus | NA | NA | NA | TCMID* | |||
NPO2715.1 | Murraya paniculata var. exotica | Varieties | Rutaceae | Eukaryota | TCMID* | |||
NPO8187 | Schisandra chinensis | Species | Schisandraceae | Eukaryota | TCMID* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT2 | Others | Unspecified | Potency | 43641.2 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 48966.2 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 54941 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 68589.6 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 43277.1 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 30637.9 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 54482.7 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 34665.4 | nM | PubChem BioAssay data set |
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 NPC200129 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 |
---|---|---|
0.8298 | Intermediate Similarity | NPC227670 |
0.8298 | Intermediate Similarity | NPC141777 |
0.8298 | Intermediate Similarity | NPC166362 |
0.8 | Intermediate Similarity | NPC178644 |
0.7963 | Intermediate Similarity | NPC123194 |
0.7959 | Intermediate Similarity | NPC241784 |
0.7959 | Intermediate Similarity | NPC229403 |
0.7959 | Intermediate Similarity | NPC86683 |
0.7959 | Intermediate Similarity | NPC13991 |
0.7959 | Intermediate Similarity | NPC296337 |
0.7959 | Intermediate Similarity | NPC49088 |
0.7959 | Intermediate Similarity | NPC114239 |
0.7917 | Intermediate Similarity | NPC192529 |
0.7857 | Intermediate Similarity | NPC469769 |
0.7843 | Intermediate Similarity | NPC17518 |
0.78 | Intermediate Similarity | NPC323445 |
0.7755 | Intermediate Similarity | NPC202189 |
0.7755 | Intermediate Similarity | NPC248411 |
0.7647 | Intermediate Similarity | NPC124851 |
0.7551 | Intermediate Similarity | NPC474118 |
0.7551 | Intermediate Similarity | NPC51762 |
0.7541 | Intermediate Similarity | NPC176171 |
0.75 | Intermediate Similarity | NPC22765 |
0.7347 | Intermediate Similarity | NPC190232 |
0.7347 | Intermediate Similarity | NPC473912 |
0.7347 | Intermediate Similarity | NPC105246 |
0.7321 | Intermediate Similarity | NPC470893 |
0.7288 | Intermediate Similarity | NPC234264 |
0.7288 | Intermediate Similarity | NPC47840 |
0.7234 | Intermediate Similarity | NPC139717 |
0.7234 | Intermediate Similarity | NPC297643 |
0.7234 | Intermediate Similarity | NPC229262 |
0.7222 | Intermediate Similarity | NPC471681 |
0.7213 | Intermediate Similarity | NPC475704 |
0.7143 | Intermediate Similarity | NPC473614 |
0.7119 | Intermediate Similarity | NPC309825 |
0.7049 | Intermediate Similarity | NPC124112 |
0.7049 | Intermediate Similarity | NPC474086 |
0.7021 | Intermediate Similarity | NPC190810 |
0.7021 | Intermediate Similarity | NPC34764 |
0.7021 | Intermediate Similarity | NPC76145 |
0.7018 | Intermediate Similarity | NPC469770 |
0.7 | Intermediate Similarity | NPC135648 |
0.7 | Intermediate Similarity | NPC177470 |
0.7 | Intermediate Similarity | NPC193180 |
0.6984 | Remote Similarity | NPC135650 |
0.6984 | Remote Similarity | NPC92327 |
0.6964 | Remote Similarity | NPC127944 |
0.6939 | Remote Similarity | NPC246165 |
0.6885 | Remote Similarity | NPC213152 |
0.6875 | Remote Similarity | NPC176107 |
0.6863 | Remote Similarity | NPC23145 |
0.6863 | Remote Similarity | NPC109813 |
0.6863 | Remote Similarity | NPC86538 |
0.6863 | Remote Similarity | NPC90803 |
0.6863 | Remote Similarity | NPC60556 |
0.6863 | Remote Similarity | NPC90506 |
0.68 | Remote Similarity | NPC103290 |
0.68 | Remote Similarity | NPC144023 |
0.6786 | Remote Similarity | NPC473728 |
0.678 | Remote Similarity | NPC475696 |
0.678 | Remote Similarity | NPC474528 |
0.678 | Remote Similarity | NPC474415 |
0.6774 | Remote Similarity | NPC165695 |
0.6774 | Remote Similarity | NPC472306 |
0.6769 | Remote Similarity | NPC20610 |
0.6721 | Remote Similarity | NPC270042 |
0.6667 | Remote Similarity | NPC182815 |
0.6667 | Remote Similarity | NPC212210 |
0.6613 | Remote Similarity | NPC147524 |
0.66 | Remote Similarity | NPC227632 |
0.66 | Remote Similarity | NPC62086 |
0.66 | Remote Similarity | NPC78551 |
0.66 | Remote Similarity | NPC183670 |
0.6567 | Remote Similarity | NPC475728 |
0.6567 | Remote Similarity | NPC35734 |
0.6567 | Remote Similarity | NPC282593 |
0.6567 | Remote Similarity | NPC307176 |
0.6567 | Remote Similarity | NPC159577 |
0.6557 | Remote Similarity | NPC475716 |
0.6557 | Remote Similarity | NPC474454 |
0.6557 | Remote Similarity | NPC474455 |
0.6557 | Remote Similarity | NPC474420 |
0.6552 | Remote Similarity | NPC5626 |
0.6545 | Remote Similarity | NPC17810 |
0.6531 | Remote Similarity | NPC239039 |
0.6515 | Remote Similarity | NPC160209 |
0.65 | Remote Similarity | NPC267626 |
0.65 | Remote Similarity | NPC474457 |
0.65 | Remote Similarity | NPC55004 |
0.65 | Remote Similarity | NPC49575 |
0.6471 | Remote Similarity | NPC21773 |
0.6471 | Remote Similarity | NPC470078 |
0.6471 | Remote Similarity | NPC5701 |
0.6471 | Remote Similarity | NPC304983 |
0.6471 | Remote Similarity | NPC115023 |
0.6462 | Remote Similarity | NPC323005 |
0.6418 | Remote Similarity | NPC139397 |
0.6393 | Remote Similarity | NPC472830 |
0.6379 | Remote Similarity | NPC14002 |
0.6379 | Remote Similarity | NPC23117 |
0.6377 | Remote Similarity | NPC470045 |
0.6377 | Remote Similarity | NPC303613 |
0.6377 | Remote Similarity | NPC474228 |
0.6377 | Remote Similarity | NPC251705 |
0.6377 | Remote Similarity | NPC470044 |
0.6377 | Remote Similarity | NPC474140 |
0.6364 | Remote Similarity | NPC475523 |
0.6349 | Remote Similarity | NPC469728 |
0.6349 | Remote Similarity | NPC219621 |
0.6338 | Remote Similarity | NPC7214 |
0.6324 | Remote Similarity | NPC2634 |
0.6324 | Remote Similarity | NPC265782 |
0.6324 | Remote Similarity | NPC214770 |
0.6324 | Remote Similarity | NPC477856 |
0.6324 | Remote Similarity | NPC260040 |
0.6324 | Remote Similarity | NPC251929 |
0.629 | Remote Similarity | NPC472827 |
0.629 | Remote Similarity | NPC5698 |
0.6286 | Remote Similarity | NPC255021 |
0.6286 | Remote Similarity | NPC476904 |
0.6232 | Remote Similarity | NPC265789 |
0.6232 | Remote Similarity | NPC54123 |
0.6232 | Remote Similarity | NPC234707 |
0.6232 | Remote Similarity | NPC305501 |
0.623 | Remote Similarity | NPC11130 |
0.623 | Remote Similarity | NPC230823 |
0.623 | Remote Similarity | NPC470370 |
0.623 | Remote Similarity | NPC470369 |
0.6212 | Remote Similarity | NPC162309 |
0.6207 | Remote Similarity | NPC179169 |
0.6207 | Remote Similarity | NPC181255 |
0.6207 | Remote Similarity | NPC35519 |
0.6207 | Remote Similarity | NPC306195 |
0.6207 | Remote Similarity | NPC157781 |
0.62 | Remote Similarity | NPC45727 |
0.62 | Remote Similarity | NPC48638 |
0.6197 | Remote Similarity | NPC22105 |
0.6197 | Remote Similarity | NPC293803 |
0.6197 | Remote Similarity | NPC471468 |
0.6197 | Remote Similarity | NPC141071 |
0.6197 | Remote Similarity | NPC313185 |
0.6197 | Remote Similarity | NPC125828 |
0.6197 | Remote Similarity | NPC288035 |
0.6197 | Remote Similarity | NPC471723 |
0.6197 | Remote Similarity | NPC230301 |
0.6197 | Remote Similarity | NPC304309 |
0.6197 | Remote Similarity | NPC162742 |
0.6197 | Remote Similarity | NPC28657 |
0.6197 | Remote Similarity | NPC134847 |
0.6197 | Remote Similarity | NPC257347 |
0.6197 | Remote Similarity | NPC285893 |
0.6197 | Remote Similarity | NPC136188 |
0.619 | Remote Similarity | NPC252809 |
0.619 | Remote Similarity | NPC323153 |
0.619 | Remote Similarity | NPC25853 |
0.619 | Remote Similarity | NPC176621 |
0.619 | Remote Similarity | NPC311809 |
0.619 | Remote Similarity | NPC127582 |
0.617 | Remote Similarity | NPC213749 |
0.6164 | Remote Similarity | NPC228911 |
0.6154 | Remote Similarity | NPC285371 |
0.6154 | Remote Similarity | NPC218918 |
0.6154 | Remote Similarity | NPC120926 |
0.6154 | Remote Similarity | NPC475124 |
0.6154 | Remote Similarity | NPC6697 |
0.6154 | Remote Similarity | NPC469662 |
0.6129 | Remote Similarity | NPC308108 |
0.6129 | Remote Similarity | NPC94991 |
0.6129 | Remote Similarity | NPC30215 |
0.6129 | Remote Similarity | NPC170799 |
0.6129 | Remote Similarity | NPC266295 |
0.6129 | Remote Similarity | NPC60772 |
0.6122 | Remote Similarity | NPC92224 |
0.6119 | Remote Similarity | NPC308522 |
0.6119 | Remote Similarity | NPC74885 |
0.6111 | Remote Similarity | NPC113733 |
0.6111 | Remote Similarity | NPC240604 |
0.6111 | Remote Similarity | NPC46160 |
0.6111 | Remote Similarity | NPC470362 |
0.6111 | Remote Similarity | NPC107059 |
0.6111 | Remote Similarity | NPC300324 |
0.6111 | Remote Similarity | NPC321016 |
0.6111 | Remote Similarity | NPC202642 |
0.6111 | Remote Similarity | NPC189883 |
0.6111 | Remote Similarity | NPC474463 |
0.6111 | Remote Similarity | NPC321381 |
0.6111 | Remote Similarity | NPC69408 |
0.6111 | Remote Similarity | NPC244488 |
0.6111 | Remote Similarity | NPC247325 |
0.6111 | Remote Similarity | NPC134330 |
0.6111 | Remote Similarity | NPC129165 |
0.6102 | Remote Similarity | NPC295777 |
0.6102 | Remote Similarity | NPC69898 |
0.6102 | Remote Similarity | NPC476679 |
0.6094 | Remote Similarity | NPC60565 |
0.6087 | Remote Similarity | NPC40574 |
0.6066 | Remote Similarity | NPC179024 |
0.6061 | Remote Similarity | NPC163678 |
0.6056 | Remote Similarity | NPC309852 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC200129 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 |
---|---|---|---|
0.7347 | Intermediate Similarity | NPD1799 | Clinical (unspecified phase) |
0.7021 | Intermediate Similarity | NPD319 | Phase 1 |
0.6567 | Remote Similarity | NPD6939 | Phase 2 |
0.6567 | Remote Similarity | NPD4747 | Approved |
0.6567 | Remote Similarity | NPD6938 | Clinical (unspecified phase) |
0.6545 | Remote Similarity | NPD8262 | Approved |
0.6515 | Remote Similarity | NPD3621 | Clinical (unspecified phase) |
0.6471 | Remote Similarity | NPD4243 | Approved |
0.6418 | Remote Similarity | NPD4137 | Phase 3 |
0.6324 | Remote Similarity | NPD4691 | Approved |
0.6286 | Remote Similarity | NPD5733 | Approved |
0.6286 | Remote Similarity | NPD4687 | Approved |
0.6286 | Remote Similarity | NPD4785 | Approved |
0.6286 | Remote Similarity | NPD4784 | Approved |
0.6232 | Remote Similarity | NPD5276 | Approved |
0.6197 | Remote Similarity | NPD6942 | Approved |
0.6197 | Remote Similarity | NPD4190 | Phase 3 |
0.6197 | Remote Similarity | NPD5275 | Approved |
0.6197 | Remote Similarity | NPD7339 | Approved |
0.6129 | Remote Similarity | NPD287 | Approved |
0.6056 | Remote Similarity | NPD4058 | Approved |
0.5942 | Remote Similarity | NPD6922 | Approved |
0.5942 | Remote Similarity | NPD6923 | Approved |
0.589 | Remote Similarity | NPD3701 | Clinical (unspecified phase) |
0.5867 | Remote Similarity | NPD4195 | Approved |
0.5857 | Remote Similarity | NPD7143 | Approved |
0.5857 | Remote Similarity | NPD7144 | Approved |
0.5806 | Remote Similarity | NPD4219 | Approved |
0.5775 | Remote Similarity | NPD7150 | Approved |
0.5775 | Remote Similarity | NPD7152 | Approved |
0.5775 | Remote Similarity | NPD7151 | Approved |
0.5641 | Remote Similarity | NPD4221 | Approved |
0.5641 | Remote Similarity | NPD4223 | Phase 3 |
0.5616 | Remote Similarity | NPD6926 | Approved |
0.5616 | Remote Similarity | NPD6924 | Approved |
PubChem CID   | 11127402 |
ChEMBL   | CHEMBL3183415 |
ZINC   |
Molecular Weight:   | 204.19 |
ALogP:   | 2.3819 |
MLogP:   | 3.11 |
XLogP:   | 6.198 |
# Rotatable Bonds:   | 4 |
Polar Surface Area:   | 0 |
# H-Bond Aceptor:   | 0 |
# H-Bond Donor:   | 0 |
# Rings:   | 3 |
# Heavy Atoms:   | 15 |