Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO21390 | Zanthoxylum integrifoliolum | Species | Rutaceae | Eukaryota | fruit | Lanyu Island, Taitung County, Taiwan |
PMID[10395498] |
|
NPO5315 | Zanthoxylum bungeanum | Species | Rutaceae | Eukaryota | TM-MC* | |||
NPO9290 | Zanthoxylum piperitum | Species | Rutaceae | Eukaryota | TM-MC* | |||
NPO8698 | Zanthoxylum schinifolium | Species | Rutaceae | Eukaryota | TM-MC* | |||
NPO21390 | Zanthoxylum integrifoliolum | Species | Rutaceae | Eukaryota | TCMID* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT2 | Others | Unspecified | Activity | = | 74 | % | 10395498 | |
NPT2 | Others | Unspecified | Activity | = | 0 | % | 10395498 | |
NPT2 | Others | Unspecified | Activity | = | 58.3 | % | 10395498 | |
NPT2 | Others | Unspecified | Activity | = | 6.7 | % | 10395498 | |
NPT2 | Others | Unspecified | Activity | = | 82.7 | % | 10395498 | |
NPT2 | Others | Unspecified | Ratio IC50 | = | 2556 | 24175626 | ||
NPT1287 | Individual Protein | Cannabinoid CB2 receptor | Homo sapiens | Inhibition | = | 73 | % | 24175626 |
NPT1287 | Individual Protein | Cannabinoid CB2 receptor | Homo sapiens | IC50 | = | 2 | nM | 24175626 |
NPT232 | Individual Protein | Cannabinoid CB1 receptor | Homo sapiens | Inhibition | = | 30 | % | 24175626 |
NPT232 | Individual Protein | Cannabinoid CB1 receptor | Homo sapiens | IC50 | = | 4600 | nM | 24175626 |
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 NPC312826 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 |
---|---|---|
0.9107 | High Similarity | NPC306420 |
0.9107 | High Similarity | NPC104138 |
0.9107 | High Similarity | NPC261158 |
0.9107 | High Similarity | NPC24216 |
0.9091 | High Similarity | NPC184014 |
0.9091 | High Similarity | NPC269800 |
0.9091 | High Similarity | NPC132669 |
0.9091 | High Similarity | NPC14234 |
0.9091 | High Similarity | NPC246519 |
0.9091 | High Similarity | NPC44193 |
0.8929 | High Similarity | NPC297020 |
0.8929 | High Similarity | NPC273023 |
0.8571 | High Similarity | NPC303672 |
0.8393 | Intermediate Similarity | NPC195986 |
0.8276 | Intermediate Similarity | NPC471992 |
0.8254 | Intermediate Similarity | NPC477525 |
0.8226 | Intermediate Similarity | NPC471023 |
0.8214 | Intermediate Similarity | NPC145032 |
0.8214 | Intermediate Similarity | NPC267340 |
0.8214 | Intermediate Similarity | NPC304223 |
0.8214 | Intermediate Similarity | NPC54542 |
0.8214 | Intermediate Similarity | NPC243539 |
0.8197 | Intermediate Similarity | NPC6795 |
0.8197 | Intermediate Similarity | NPC130807 |
0.8125 | Intermediate Similarity | NPC187315 |
0.8036 | Intermediate Similarity | NPC307435 |
0.8036 | Intermediate Similarity | NPC267692 |
0.7966 | Intermediate Similarity | NPC471991 |
0.7931 | Intermediate Similarity | NPC119655 |
0.7812 | Intermediate Similarity | NPC253468 |
0.7812 | Intermediate Similarity | NPC235311 |
0.7797 | Intermediate Similarity | NPC163912 |
0.7797 | Intermediate Similarity | NPC167759 |
0.7797 | Intermediate Similarity | NPC305288 |
0.7797 | Intermediate Similarity | NPC56028 |
0.7778 | Intermediate Similarity | NPC29468 |
0.7742 | Intermediate Similarity | NPC74617 |
0.7742 | Intermediate Similarity | NPC150505 |
0.7656 | Intermediate Similarity | NPC77891 |
0.7576 | Intermediate Similarity | NPC129995 |
0.7576 | Intermediate Similarity | NPC315141 |
0.7541 | Intermediate Similarity | NPC477049 |
0.75 | Intermediate Similarity | NPC13011 |
0.75 | Intermediate Similarity | NPC124382 |
0.75 | Intermediate Similarity | NPC471022 |
0.75 | Intermediate Similarity | NPC123669 |
0.7419 | Intermediate Similarity | NPC245650 |
0.7385 | Intermediate Similarity | NPC182758 |
0.7353 | Intermediate Similarity | NPC249713 |
0.7344 | Intermediate Similarity | NPC309877 |
0.7258 | Intermediate Similarity | NPC4881 |
0.7246 | Intermediate Similarity | NPC103712 |
0.7246 | Intermediate Similarity | NPC291196 |
0.7231 | Intermediate Similarity | NPC273614 |
0.7231 | Intermediate Similarity | NPC324077 |
0.7188 | Intermediate Similarity | NPC329003 |
0.7188 | Intermediate Similarity | NPC326524 |
0.7188 | Intermediate Similarity | NPC325550 |
0.7183 | Intermediate Similarity | NPC314678 |
0.7097 | Intermediate Similarity | NPC242930 |
0.7031 | Intermediate Similarity | NPC321030 |
0.7 | Intermediate Similarity | NPC45060 |
0.7 | Intermediate Similarity | NPC280065 |
0.6866 | Remote Similarity | NPC316674 |
0.6849 | Remote Similarity | NPC288086 |
0.678 | Remote Similarity | NPC91044 |
0.6769 | Remote Similarity | NPC325734 |
0.675 | Remote Similarity | NPC3210 |
0.6618 | Remote Similarity | NPC55068 |
0.6613 | Remote Similarity | NPC208638 |
0.6452 | Remote Similarity | NPC261571 |
0.6379 | Remote Similarity | NPC86121 |
0.6377 | Remote Similarity | NPC477106 |
0.6349 | Remote Similarity | NPC188341 |
0.6349 | Remote Similarity | NPC49494 |
0.6316 | Remote Similarity | NPC476923 |
0.6271 | Remote Similarity | NPC138935 |
0.6269 | Remote Similarity | NPC210999 |
0.625 | Remote Similarity | NPC82799 |
0.619 | Remote Similarity | NPC473672 |
0.619 | Remote Similarity | NPC59408 |
0.619 | Remote Similarity | NPC71053 |
0.619 | Remote Similarity | NPC474495 |
0.6173 | Remote Similarity | NPC14326 |
0.6173 | Remote Similarity | NPC39966 |
0.6173 | Remote Similarity | NPC224072 |
0.6129 | Remote Similarity | NPC31194 |
0.6129 | Remote Similarity | NPC248884 |
0.6129 | Remote Similarity | NPC85079 |
0.6104 | Remote Similarity | NPC476924 |
0.6104 | Remote Similarity | NPC217095 |
0.6104 | Remote Similarity | NPC264417 |
0.6102 | Remote Similarity | NPC470439 |
0.6087 | Remote Similarity | NPC176621 |
0.6066 | Remote Similarity | NPC180575 |
0.6032 | Remote Similarity | NPC474460 |
0.6032 | Remote Similarity | NPC474642 |
0.6032 | Remote Similarity | NPC249670 |
0.6032 | Remote Similarity | NPC72699 |
0.6032 | Remote Similarity | NPC477727 |
0.6032 | Remote Similarity | NPC199286 |
0.6032 | Remote Similarity | NPC471281 |
0.6032 | Remote Similarity | NPC473913 |
0.6 | Remote Similarity | NPC314854 |
0.6 | Remote Similarity | NPC313911 |
0.6 | Remote Similarity | NPC61177 |
0.6 | Remote Similarity | NPC175614 |
0.6 | Remote Similarity | NPC324638 |
0.5972 | Remote Similarity | NPC308844 |
0.5946 | Remote Similarity | NPC474812 |
0.5938 | Remote Similarity | NPC151782 |
0.5938 | Remote Similarity | NPC224148 |
0.5938 | Remote Similarity | NPC197272 |
0.5938 | Remote Similarity | NPC165447 |
0.5938 | Remote Similarity | NPC471959 |
0.5938 | Remote Similarity | NPC477723 |
0.5938 | Remote Similarity | NPC475477 |
0.5938 | Remote Similarity | NPC256656 |
0.5938 | Remote Similarity | NPC9273 |
0.5938 | Remote Similarity | NPC89824 |
0.5938 | Remote Similarity | NPC55383 |
0.5938 | Remote Similarity | NPC76198 |
0.5938 | Remote Similarity | NPC329608 |
0.5938 | Remote Similarity | NPC170776 |
0.5938 | Remote Similarity | NPC294278 |
0.593 | Remote Similarity | NPC316186 |
0.5909 | Remote Similarity | NPC110732 |
0.5902 | Remote Similarity | NPC299114 |
0.5902 | Remote Similarity | NPC269074 |
0.5875 | Remote Similarity | NPC474833 |
0.5875 | Remote Similarity | NPC473695 |
0.5875 | Remote Similarity | NPC473446 |
0.5873 | Remote Similarity | NPC153538 |
0.5873 | Remote Similarity | NPC471276 |
0.5873 | Remote Similarity | NPC471280 |
0.5873 | Remote Similarity | NPC125122 |
0.5873 | Remote Similarity | NPC471275 |
0.5833 | Remote Similarity | NPC116934 |
0.5824 | Remote Similarity | NPC45313 |
0.5824 | Remote Similarity | NPC8098 |
0.5824 | Remote Similarity | NPC183449 |
0.5824 | Remote Similarity | NPC197294 |
0.5821 | Remote Similarity | NPC329686 |
0.5821 | Remote Similarity | NPC474644 |
0.5814 | Remote Similarity | NPC473031 |
0.5806 | Remote Similarity | NPC55063 |
0.5806 | Remote Similarity | NPC124183 |
0.5806 | Remote Similarity | NPC19834 |
0.5806 | Remote Similarity | NPC35141 |
0.5802 | Remote Similarity | NPC471597 |
0.5797 | Remote Similarity | NPC181872 |
0.5781 | Remote Similarity | NPC26960 |
0.5781 | Remote Similarity | NPC328784 |
0.5781 | Remote Similarity | NPC291437 |
0.5781 | Remote Similarity | NPC182102 |
0.5778 | Remote Similarity | NPC54961 |
0.5778 | Remote Similarity | NPC157353 |
0.5778 | Remote Similarity | NPC158445 |
0.5778 | Remote Similarity | NPC156782 |
0.5778 | Remote Similarity | NPC282088 |
0.5775 | Remote Similarity | NPC469728 |
0.5763 | Remote Similarity | NPC269823 |
0.5758 | Remote Similarity | NPC34577 |
0.5758 | Remote Similarity | NPC474496 |
0.5735 | Remote Similarity | NPC473865 |
0.5735 | Remote Similarity | NPC249645 |
0.5735 | Remote Similarity | NPC474643 |
0.5735 | Remote Similarity | NPC55412 |
0.5732 | Remote Similarity | NPC476560 |
0.5714 | Remote Similarity | NPC228638 |
0.5714 | Remote Similarity | NPC469836 |
0.5698 | Remote Similarity | NPC203076 |
0.5692 | Remote Similarity | NPC93639 |
0.569 | Remote Similarity | NPC15934 |
0.5676 | Remote Similarity | NPC113224 |
0.5672 | Remote Similarity | NPC256209 |
0.5672 | Remote Similarity | NPC49059 |
0.5672 | Remote Similarity | NPC48058 |
0.5672 | Remote Similarity | NPC473532 |
0.5667 | Remote Similarity | NPC206906 |
0.5667 | Remote Similarity | NPC209279 |
0.5667 | Remote Similarity | NPC108494 |
0.5667 | Remote Similarity | NPC213538 |
0.5667 | Remote Similarity | NPC51758 |
0.5667 | Remote Similarity | NPC180871 |
0.5667 | Remote Similarity | NPC194586 |
0.5667 | Remote Similarity | NPC68889 |
0.5667 | Remote Similarity | NPC256766 |
0.5667 | Remote Similarity | NPC67761 |
0.5667 | Remote Similarity | NPC88079 |
0.5658 | Remote Similarity | NPC137620 |
0.5658 | Remote Similarity | NPC474675 |
0.5658 | Remote Similarity | NPC475930 |
0.5658 | Remote Similarity | NPC127145 |
0.5652 | Remote Similarity | NPC44542 |
0.5647 | Remote Similarity | NPC477199 |
0.5645 | Remote Similarity | NPC140501 |
0.5645 | Remote Similarity | NPC160628 |
0.5634 | Remote Similarity | NPC327112 |
0.5632 | Remote Similarity | NPC472614 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC312826 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 |
---|---|---|---|
0.6618 | Remote Similarity | NPD3210 | Clinical (unspecified phase) |
0.6167 | Remote Similarity | NPD860 | Phase 2 |
0.6 | Remote Similarity | NPD3212 | Clinical (unspecified phase) |
0.5873 | Remote Similarity | NPD4220 | Pre-registration |
0.5775 | Remote Similarity | NPD6949 | Clinical (unspecified phase) |
0.5735 | Remote Similarity | NPD4219 | Approved |
0.5645 | Remote Similarity | NPD4265 | Approved |
0.5634 | Remote Similarity | NPD4246 | Clinical (unspecified phase) |
0.5618 | Remote Similarity | NPD8522 | Clinical (unspecified phase) |
PubChem CID   | 5321844 |
ChEMBL   | CHEMBL452912 |
ZINC   |
Molecular Weight:   | 295.25 |
ALogP:   | -1.0406 |
MLogP:   | 3.11 |
XLogP:   | 6.253 |
# Rotatable Bonds:   | 17 |
Polar Surface Area:   | 52.82 |
# H-Bond Aceptor:   | 3 |
# H-Bond Donor:   | 2 |
# Rings:   | 0 |
# Heavy Atoms:   | 21 |