Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO23708 | Aster koraiensis | Species | Asteraceae | Eukaryota | Aerial parts | Euidang-myun, Gongju city, Chungchengnam-do, Republic of Korea | 2007-AUG |
PMID[22264115] |
NPO15816 | Gymnaster koraiensis | NA | NA | NA | TCMID* |
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 NPC93639 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 |
---|---|---|
0.9574 | High Similarity | NPC153538 |
0.9375 | High Similarity | NPC72699 |
0.9184 | High Similarity | NPC151782 |
0.9167 | High Similarity | NPC85079 |
0.9167 | High Similarity | NPC248884 |
0.9167 | High Similarity | NPC31194 |
0.9149 | High Similarity | NPC35141 |
0.9149 | High Similarity | NPC124183 |
0.88 | High Similarity | NPC59408 |
0.88 | High Similarity | NPC71053 |
0.8776 | High Similarity | NPC471276 |
0.8776 | High Similarity | NPC125122 |
0.8776 | High Similarity | NPC471275 |
0.8776 | High Similarity | NPC471280 |
0.875 | High Similarity | NPC157096 |
0.875 | High Similarity | NPC19834 |
0.875 | High Similarity | NPC55063 |
0.8723 | High Similarity | NPC101616 |
0.8654 | High Similarity | NPC110732 |
0.8654 | High Similarity | NPC256209 |
0.8654 | High Similarity | NPC49059 |
0.8627 | High Similarity | NPC142092 |
0.86 | High Similarity | NPC471281 |
0.86 | High Similarity | NPC199286 |
0.86 | High Similarity | NPC291437 |
0.86 | High Similarity | NPC474642 |
0.86 | High Similarity | NPC249670 |
0.86 | High Similarity | NPC328784 |
0.86 | High Similarity | NPC473913 |
0.86 | High Similarity | NPC477727 |
0.8542 | High Similarity | NPC269074 |
0.8431 | Intermediate Similarity | NPC477723 |
0.8431 | Intermediate Similarity | NPC9273 |
0.8431 | Intermediate Similarity | NPC165447 |
0.8431 | Intermediate Similarity | NPC329608 |
0.8431 | Intermediate Similarity | NPC256656 |
0.8431 | Intermediate Similarity | NPC294278 |
0.8431 | Intermediate Similarity | NPC76198 |
0.8431 | Intermediate Similarity | NPC55383 |
0.8431 | Intermediate Similarity | NPC170776 |
0.8431 | Intermediate Similarity | NPC197272 |
0.8431 | Intermediate Similarity | NPC224148 |
0.8431 | Intermediate Similarity | NPC475477 |
0.8431 | Intermediate Similarity | NPC471959 |
0.8431 | Intermediate Similarity | NPC89824 |
0.84 | Intermediate Similarity | NPC302310 |
0.8367 | Intermediate Similarity | NPC180575 |
0.8302 | Intermediate Similarity | NPC473532 |
0.8298 | Intermediate Similarity | NPC304151 |
0.8235 | Intermediate Similarity | NPC473768 |
0.8148 | Intermediate Similarity | NPC477725 |
0.8148 | Intermediate Similarity | NPC473896 |
0.8148 | Intermediate Similarity | NPC473725 |
0.8148 | Intermediate Similarity | NPC473910 |
0.8148 | Intermediate Similarity | NPC477726 |
0.8148 | Intermediate Similarity | NPC473735 |
0.8148 | Intermediate Similarity | NPC473721 |
0.8148 | Intermediate Similarity | NPC475353 |
0.8077 | Intermediate Similarity | NPC129263 |
0.8077 | Intermediate Similarity | NPC29234 |
0.8 | Intermediate Similarity | NPC470967 |
0.8 | Intermediate Similarity | NPC470969 |
0.8 | Intermediate Similarity | NPC471960 |
0.8 | Intermediate Similarity | NPC470968 |
0.8 | Intermediate Similarity | NPC161838 |
0.8 | Intermediate Similarity | NPC477661 |
0.8 | Intermediate Similarity | NPC470966 |
0.8 | Intermediate Similarity | NPC473847 |
0.8 | Intermediate Similarity | NPC475384 |
0.7963 | Intermediate Similarity | NPC48058 |
0.7959 | Intermediate Similarity | NPC108195 |
0.7857 | Intermediate Similarity | NPC193975 |
0.7857 | Intermediate Similarity | NPC212730 |
0.7857 | Intermediate Similarity | NPC265551 |
0.7857 | Intermediate Similarity | NPC470970 |
0.7818 | Intermediate Similarity | NPC470963 |
0.7818 | Intermediate Similarity | NPC152668 |
0.7818 | Intermediate Similarity | NPC146551 |
0.7818 | Intermediate Similarity | NPC474513 |
0.7818 | Intermediate Similarity | NPC471239 |
0.7818 | Intermediate Similarity | NPC474644 |
0.78 | Intermediate Similarity | NPC276825 |
0.7778 | Intermediate Similarity | NPC61177 |
0.7778 | Intermediate Similarity | NPC34577 |
0.7736 | Intermediate Similarity | NPC473672 |
0.7736 | Intermediate Similarity | NPC474495 |
0.7692 | Intermediate Similarity | NPC475153 |
0.7679 | Intermediate Similarity | NPC474643 |
0.7679 | Intermediate Similarity | NPC470964 |
0.7679 | Intermediate Similarity | NPC311648 |
0.7679 | Intermediate Similarity | NPC473865 |
0.766 | Intermediate Similarity | NPC15934 |
0.7551 | Intermediate Similarity | NPC149668 |
0.7551 | Intermediate Similarity | NPC206906 |
0.7544 | Intermediate Similarity | NPC44542 |
0.7544 | Intermediate Similarity | NPC472445 |
0.7544 | Intermediate Similarity | NPC594 |
0.7544 | Intermediate Similarity | NPC121034 |
0.7544 | Intermediate Similarity | NPC48968 |
0.75 | Intermediate Similarity | NPC29697 |
0.75 | Intermediate Similarity | NPC329762 |
0.75 | Intermediate Similarity | NPC103236 |
0.75 | Intermediate Similarity | NPC227135 |
0.75 | Intermediate Similarity | NPC27444 |
0.7458 | Intermediate Similarity | NPC471278 |
0.7455 | Intermediate Similarity | NPC187361 |
0.7455 | Intermediate Similarity | NPC477724 |
0.7455 | Intermediate Similarity | NPC284224 |
0.7455 | Intermediate Similarity | NPC474496 |
0.7455 | Intermediate Similarity | NPC26102 |
0.74 | Intermediate Similarity | NPC116934 |
0.7333 | Intermediate Similarity | NPC475984 |
0.7333 | Intermediate Similarity | NPC271282 |
0.7333 | Intermediate Similarity | NPC325929 |
0.7333 | Intermediate Similarity | NPC66460 |
0.7288 | Intermediate Similarity | NPC222852 |
0.7288 | Intermediate Similarity | NPC473866 |
0.7288 | Intermediate Similarity | NPC473652 |
0.7273 | Intermediate Similarity | NPC35756 |
0.7241 | Intermediate Similarity | NPC474577 |
0.7222 | Intermediate Similarity | NPC474460 |
0.7213 | Intermediate Similarity | NPC470965 |
0.72 | Intermediate Similarity | NPC31121 |
0.72 | Intermediate Similarity | NPC46248 |
0.72 | Intermediate Similarity | NPC249801 |
0.7193 | Intermediate Similarity | NPC317899 |
0.7143 | Intermediate Similarity | NPC217188 |
0.7119 | Intermediate Similarity | NPC181872 |
0.7115 | Intermediate Similarity | NPC160628 |
0.7115 | Intermediate Similarity | NPC140501 |
0.7097 | Intermediate Similarity | NPC226592 |
0.7097 | Intermediate Similarity | NPC470320 |
0.7091 | Intermediate Similarity | NPC200772 |
0.7049 | Intermediate Similarity | NPC168407 |
0.7037 | Intermediate Similarity | NPC267110 |
0.7021 | Intermediate Similarity | NPC213767 |
0.7 | Intermediate Similarity | NPC322186 |
0.7 | Intermediate Similarity | NPC269823 |
0.6964 | Remote Similarity | NPC473705 |
0.6939 | Remote Similarity | NPC103213 |
0.6939 | Remote Similarity | NPC306850 |
0.6939 | Remote Similarity | NPC29091 |
0.6939 | Remote Similarity | NPC182840 |
0.6939 | Remote Similarity | NPC255042 |
0.6923 | Remote Similarity | NPC473539 |
0.6923 | Remote Similarity | NPC474413 |
0.6923 | Remote Similarity | NPC138935 |
0.6909 | Remote Similarity | NPC475071 |
0.6909 | Remote Similarity | NPC473487 |
0.6909 | Remote Similarity | NPC288381 |
0.6909 | Remote Similarity | NPC20934 |
0.6897 | Remote Similarity | NPC281590 |
0.6897 | Remote Similarity | NPC329686 |
0.6885 | Remote Similarity | NPC327112 |
0.6875 | Remote Similarity | NPC216416 |
0.6863 | Remote Similarity | NPC213538 |
0.6863 | Remote Similarity | NPC256766 |
0.6842 | Remote Similarity | NPC475723 |
0.6833 | Remote Similarity | NPC226848 |
0.6825 | Remote Similarity | NPC475221 |
0.6809 | Remote Similarity | NPC58957 |
0.6792 | Remote Similarity | NPC76976 |
0.6792 | Remote Similarity | NPC201948 |
0.6792 | Remote Similarity | NPC474362 |
0.6792 | Remote Similarity | NPC474202 |
0.678 | Remote Similarity | NPC472808 |
0.678 | Remote Similarity | NPC324224 |
0.6774 | Remote Similarity | NPC477829 |
0.6769 | Remote Similarity | NPC99619 |
0.6769 | Remote Similarity | NPC26500 |
0.6735 | Remote Similarity | NPC34873 |
0.6735 | Remote Similarity | NPC40434 |
0.6731 | Remote Similarity | NPC252978 |
0.6724 | Remote Similarity | NPC300121 |
0.6724 | Remote Similarity | NPC189677 |
0.6721 | Remote Similarity | NPC475931 |
0.6721 | Remote Similarity | NPC122239 |
0.6667 | Remote Similarity | NPC473625 |
0.6667 | Remote Similarity | NPC471279 |
0.6667 | Remote Similarity | NPC323436 |
0.6667 | Remote Similarity | NPC471277 |
0.6667 | Remote Similarity | NPC52012 |
0.6667 | Remote Similarity | NPC79544 |
0.6667 | Remote Similarity | NPC55068 |
0.6615 | Remote Similarity | NPC267027 |
0.6613 | Remote Similarity | NPC258788 |
0.661 | Remote Similarity | NPC251666 |
0.661 | Remote Similarity | NPC232247 |
0.6607 | Remote Similarity | NPC26960 |
0.6607 | Remote Similarity | NPC182102 |
0.6596 | Remote Similarity | NPC250734 |
0.6596 | Remote Similarity | NPC81989 |
0.6557 | Remote Similarity | NPC155025 |
0.6531 | Remote Similarity | NPC174396 |
0.6515 | Remote Similarity | NPC473752 |
0.6515 | Remote Similarity | NPC25298 |
0.6515 | Remote Similarity | NPC478097 |
0.6508 | Remote Similarity | NPC113293 |
0.6508 | Remote Similarity | NPC321838 |
0.6508 | Remote Similarity | NPC26810 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC93639 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 |
---|---|---|---|
0.7115 | Intermediate Similarity | NPD4265 | Approved |
0.6885 | Remote Similarity | NPD4246 | Clinical (unspecified phase) |
0.6833 | Remote Similarity | NPD585 | Clinical (unspecified phase) |
0.6667 | Remote Similarity | NPD3210 | Clinical (unspecified phase) |
0.6308 | Remote Similarity | NPD3197 | Phase 1 |
0.625 | Remote Similarity | NPD368 | Approved |
0.623 | Remote Similarity | NPD4219 | Approved |
0.6066 | Remote Similarity | NPD342 | Phase 1 |
0.6032 | Remote Similarity | NPD6109 | Phase 1 |
0.6029 | Remote Similarity | NPD4247 | Clinical (unspecified phase) |
0.6 | Remote Similarity | NPD3212 | Clinical (unspecified phase) |
0.5893 | Remote Similarity | NPD39 | Approved |
0.5862 | Remote Similarity | NPD4220 | Pre-registration |
0.5833 | Remote Similarity | NPD4732 | Discontinued |
0.5806 | Remote Similarity | NPD4627 | Clinical (unspecified phase) |
0.5696 | Remote Similarity | NPD5332 | Approved |
0.5696 | Remote Similarity | NPD5331 | Approved |
0.5676 | Remote Similarity | NPD8264 | Approved |
0.5614 | Remote Similarity | NPD4222 | Approved |
PubChem CID   | 44566958 |
ChEMBL   | CHEMBL501416 |
ZINC   |
Molecular Weight:   | 276.17 |
ALogP:   | 0.5225 |
MLogP:   | 3 |
XLogP:   | 3.581 |
# Rotatable Bonds:   | 12 |
Polar Surface Area:   | 60.69 |
# H-Bond Aceptor:   | 3 |
# H-Bond Donor:   | 3 |
# Rings:   | 0 |
# Heavy Atoms:   | 20 |