Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO20930 | Patrinia scabiosifolia | Species | Caprifoliaceae | Eukaryota | TM-MC* | |||
NPO9090 | Patrinia villosa | Species | Caprifoliaceae | Eukaryota | TM-MC* | |||
NPO8650 | Perilla frutescens | Species | Lamiaceae | Eukaryota | TM-MC* | |||
NPO13524 | Pyrola japonica | Species | Ericaceae | Eukaryota | TM-MC* | |||
NPO21072 | Rhododendron dauricum | Species | Ericaceae | Eukaryota | TM-MC* | |||
NPO16039 | Scutellaria barbata | Species | Lamiaceae | Eukaryota | TM-MC* | |||
NPO1596 | Taraxacum borealisinense | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO23327 | Taraxacum coreanum | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO26785 | Taraxacum mongolicum | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO26622 | Taraxacum officinale | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO13668 | Taraxacum platycarpum | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO1436 | Houttuynia cordata | Species | Saururaceae | Eukaryota | TCM_Taiwan* | |||
NPO1334 | Senegalia catechu | Species | Fabaceae | Eukaryota | TM-MC* | |||
NPO12935 | Thymus quinquecostatus | Species | Lamiaceae | Eukaryota | TM-MC* | |||
NPO18007 | Agrimonia pilosa | Species | Rosaceae | Eukaryota | TM-MC* | |||
NPO19472 | Thymus vulgaris | Species | Lamiaceae | Eukaryota | TM-MC* | |||
NPO3578 | Andrographis paniculata | Species | Acanthaceae | Eukaryota | TM-MC* | |||
NPO20553 | Zingiber officinale | Species | Zingiberaceae | Eukaryota | TM-MC* | |||
NPO26589 | Artemisia annua | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO14484 | Echinacea purpurea | Species | Asteraceae | Eukaryota | TCMID* | |||
NPO10506 | Artemisia apiacea | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO11100 | Artemisia capillaris | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO28260 | Senna alexandrina | Species | Fabaceae | Eukaryota | TM-MC* | |||
NPO8881 | Centipeda minima | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO22258 | Chrysanthemum indicum | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO20440 | Chrysanthemum x morifolium | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO27288 | Citrus maxima | Species | Rutaceae | Eukaryota | TM-MC* | |||
NPO25443 | Citrus reticulata | Species | Rutaceae | Eukaryota | TM-MC* | |||
NPO10082 | Citrus unshiu | Species | Rutaceae | Eukaryota | TM-MC* | |||
NPO22796 | Cyperus rotundus | Species | Cyperaceae | Eukaryota | TM-MC* | |||
NPO20295 | Eclipta prostrata | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO26277 | Euphorbia hirta | Species | Euphorbiaceae | Eukaryota | TM-MC* | |||
NPO8874 | Glehnia littoralis | Species | Apiaceae | Eukaryota | TM-MC* | |||
NPO1436 | Houttuynia cordata | Species | Saururaceae | Eukaryota | TM-MC* | |||
NPO4391 | Hypericum perforatum | Species | Hypericaceae | Eukaryota | TM-MC* | |||
NPO23548 | Leonurus japonicus | Species | Lamiaceae | Eukaryota | TM-MC* | |||
NPO25114 | Linum usitatissimum | Species | Linaceae | Eukaryota | TM-MC* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT790 | Organism | Mycobacterium tuberculosis H37Rv | Mycobacterium tuberculosis H37Rv | MIC | = | 100 | ug/ml | 20004575 |
NPT790 | Organism | Mycobacterium tuberculosis H37Rv | Mycobacterium tuberculosis H37Rv | MIC | = | 1.56 | ug/ml | 22280816 |
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 NPC182102 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 | NPC26960 |
0.8679 | High Similarity | NPC11130 |
0.86 | High Similarity | NPC244038 |
0.8491 | Intermediate Similarity | NPC474643 |
0.8491 | Intermediate Similarity | NPC473865 |
0.8364 | Intermediate Similarity | NPC122239 |
0.8302 | Intermediate Similarity | NPC474644 |
0.8302 | Intermediate Similarity | NPC329686 |
0.8261 | Intermediate Similarity | NPC269823 |
0.8214 | Intermediate Similarity | NPC471081 |
0.8182 | Intermediate Similarity | NPC181872 |
0.8148 | Intermediate Similarity | NPC249645 |
0.8148 | Intermediate Similarity | NPC55412 |
0.8085 | Intermediate Similarity | NPC256766 |
0.8085 | Intermediate Similarity | NPC213538 |
0.8036 | Intermediate Similarity | NPC475931 |
0.7917 | Intermediate Similarity | NPC116934 |
0.7885 | Intermediate Similarity | NPC474495 |
0.7885 | Intermediate Similarity | NPC473672 |
0.7857 | Intermediate Similarity | NPC226848 |
0.7826 | Intermediate Similarity | NPC29091 |
0.7826 | Intermediate Similarity | NPC103213 |
0.7826 | Intermediate Similarity | NPC255042 |
0.7826 | Intermediate Similarity | NPC182840 |
0.7755 | Intermediate Similarity | NPC138935 |
0.7736 | Intermediate Similarity | NPC208638 |
0.7719 | Intermediate Similarity | NPC309825 |
0.7692 | Intermediate Similarity | NPC474460 |
0.7667 | Intermediate Similarity | NPC19569 |
0.7667 | Intermediate Similarity | NPC308844 |
0.7636 | Intermediate Similarity | NPC232247 |
0.7636 | Intermediate Similarity | NPC148216 |
0.7636 | Intermediate Similarity | NPC130209 |
0.7636 | Intermediate Similarity | NPC148163 |
0.7636 | Intermediate Similarity | NPC251666 |
0.7636 | Intermediate Similarity | NPC298299 |
0.76 | Intermediate Similarity | NPC269074 |
0.76 | Intermediate Similarity | NPC160628 |
0.76 | Intermediate Similarity | NPC24824 |
0.76 | Intermediate Similarity | NPC165651 |
0.76 | Intermediate Similarity | NPC210560 |
0.76 | Intermediate Similarity | NPC140501 |
0.7586 | Intermediate Similarity | NPC240506 |
0.7586 | Intermediate Similarity | NPC47840 |
0.7586 | Intermediate Similarity | NPC234264 |
0.7544 | Intermediate Similarity | NPC155025 |
0.75 | Intermediate Similarity | NPC309300 |
0.75 | Intermediate Similarity | NPC96663 |
0.7447 | Intermediate Similarity | NPC15934 |
0.7419 | Intermediate Similarity | NPC114651 |
0.7419 | Intermediate Similarity | NPC69649 |
0.7419 | Intermediate Similarity | NPC259299 |
0.7419 | Intermediate Similarity | NPC68703 |
0.7407 | Intermediate Similarity | NPC68014 |
0.7358 | Intermediate Similarity | NPC249670 |
0.7358 | Intermediate Similarity | NPC474642 |
0.7358 | Intermediate Similarity | NPC473913 |
0.7358 | Intermediate Similarity | NPC329773 |
0.7333 | Intermediate Similarity | NPC473508 |
0.7333 | Intermediate Similarity | NPC473759 |
0.7333 | Intermediate Similarity | NPC124112 |
0.7333 | Intermediate Similarity | NPC474155 |
0.7302 | Intermediate Similarity | NPC305698 |
0.7302 | Intermediate Similarity | NPC224532 |
0.7288 | Intermediate Similarity | NPC99487 |
0.7288 | Intermediate Similarity | NPC66020 |
0.7288 | Intermediate Similarity | NPC176621 |
0.7273 | Intermediate Similarity | NPC474496 |
0.7255 | Intermediate Similarity | NPC87439 |
0.7213 | Intermediate Similarity | NPC475704 |
0.7213 | Intermediate Similarity | NPC300593 |
0.7193 | Intermediate Similarity | NPC48891 |
0.7188 | Intermediate Similarity | NPC239373 |
0.7188 | Intermediate Similarity | NPC329989 |
0.7174 | Intermediate Similarity | NPC92224 |
0.717 | Intermediate Similarity | NPC85079 |
0.717 | Intermediate Similarity | NPC248884 |
0.717 | Intermediate Similarity | NPC31194 |
0.7167 | Intermediate Similarity | NPC225342 |
0.7167 | Intermediate Similarity | NPC210346 |
0.7167 | Intermediate Similarity | NPC274704 |
0.7167 | Intermediate Similarity | NPC321867 |
0.7167 | Intermediate Similarity | NPC207007 |
0.7167 | Intermediate Similarity | NPC68679 |
0.7143 | Intermediate Similarity | NPC73603 |
0.7115 | Intermediate Similarity | NPC180575 |
0.7115 | Intermediate Similarity | NPC55063 |
0.7115 | Intermediate Similarity | NPC19834 |
0.7097 | Intermediate Similarity | NPC187619 |
0.7091 | Intermediate Similarity | NPC35756 |
0.7077 | Intermediate Similarity | NPC4299 |
0.7077 | Intermediate Similarity | NPC34834 |
0.7077 | Intermediate Similarity | NPC189745 |
0.7049 | Intermediate Similarity | NPC279200 |
0.7037 | Intermediate Similarity | NPC471281 |
0.7037 | Intermediate Similarity | NPC199286 |
0.7037 | Intermediate Similarity | NPC477727 |
0.7037 | Intermediate Similarity | NPC72699 |
0.7018 | Intermediate Similarity | NPC227135 |
0.7018 | Intermediate Similarity | NPC281590 |
0.7018 | Intermediate Similarity | NPC223604 |
0.7 | Intermediate Similarity | NPC304151 |
0.6984 | Remote Similarity | NPC162309 |
0.6984 | Remote Similarity | NPC202017 |
0.6984 | Remote Similarity | NPC135650 |
0.6984 | Remote Similarity | NPC267027 |
0.6984 | Remote Similarity | NPC311736 |
0.6984 | Remote Similarity | NPC326310 |
0.697 | Remote Similarity | NPC472254 |
0.697 | Remote Similarity | NPC471662 |
0.6935 | Remote Similarity | NPC96793 |
0.6935 | Remote Similarity | NPC110241 |
0.6935 | Remote Similarity | NPC225415 |
0.6935 | Remote Similarity | NPC290367 |
0.6935 | Remote Similarity | NPC323424 |
0.6935 | Remote Similarity | NPC107540 |
0.6923 | Remote Similarity | NPC471560 |
0.6923 | Remote Similarity | NPC101622 |
0.6923 | Remote Similarity | NPC76976 |
0.6909 | Remote Similarity | NPC76198 |
0.6909 | Remote Similarity | NPC9273 |
0.6909 | Remote Similarity | NPC165447 |
0.6909 | Remote Similarity | NPC170776 |
0.6909 | Remote Similarity | NPC197272 |
0.6909 | Remote Similarity | NPC475477 |
0.6909 | Remote Similarity | NPC224148 |
0.6909 | Remote Similarity | NPC151782 |
0.6909 | Remote Similarity | NPC256656 |
0.6909 | Remote Similarity | NPC471959 |
0.6909 | Remote Similarity | NPC477723 |
0.6909 | Remote Similarity | NPC89824 |
0.6909 | Remote Similarity | NPC55383 |
0.6909 | Remote Similarity | NPC294278 |
0.6909 | Remote Similarity | NPC329608 |
0.6897 | Remote Similarity | NPC4881 |
0.6885 | Remote Similarity | NPC475251 |
0.6885 | Remote Similarity | NPC469728 |
0.6875 | Remote Similarity | NPC163290 |
0.6875 | Remote Similarity | NPC266298 |
0.6875 | Remote Similarity | NPC136813 |
0.6875 | Remote Similarity | NPC477791 |
0.6875 | Remote Similarity | NPC171225 |
0.6866 | Remote Similarity | NPC474743 |
0.6866 | Remote Similarity | NPC329763 |
0.6852 | Remote Similarity | NPC62755 |
0.6852 | Remote Similarity | NPC471275 |
0.6852 | Remote Similarity | NPC153538 |
0.6852 | Remote Similarity | NPC471276 |
0.6852 | Remote Similarity | NPC125122 |
0.6852 | Remote Similarity | NPC471280 |
0.6852 | Remote Similarity | NPC267110 |
0.6833 | Remote Similarity | NPC473866 |
0.6825 | Remote Similarity | NPC107258 |
0.6825 | Remote Similarity | NPC477009 |
0.6825 | Remote Similarity | NPC238352 |
0.6818 | Remote Similarity | NPC286154 |
0.68 | Remote Similarity | NPC188596 |
0.6792 | Remote Similarity | NPC124183 |
0.6792 | Remote Similarity | NPC35141 |
0.6786 | Remote Similarity | NPC294358 |
0.6786 | Remote Similarity | NPC306195 |
0.6786 | Remote Similarity | NPC35519 |
0.6786 | Remote Similarity | NPC157781 |
0.6786 | Remote Similarity | NPC40417 |
0.6786 | Remote Similarity | NPC179169 |
0.6786 | Remote Similarity | NPC181255 |
0.678 | Remote Similarity | NPC52012 |
0.6774 | Remote Similarity | NPC474480 |
0.6769 | Remote Similarity | NPC96484 |
0.6769 | Remote Similarity | NPC167527 |
0.6765 | Remote Similarity | NPC306727 |
0.6765 | Remote Similarity | NPC201048 |
0.6765 | Remote Similarity | NPC471659 |
0.6765 | Remote Similarity | NPC476366 |
0.6731 | Remote Similarity | NPC101616 |
0.6731 | Remote Similarity | NPC108195 |
0.6727 | Remote Similarity | NPC475071 |
0.6727 | Remote Similarity | NPC131623 |
0.6721 | Remote Similarity | NPC130807 |
0.6721 | Remote Similarity | NPC127824 |
0.6719 | Remote Similarity | NPC250977 |
0.6719 | Remote Similarity | NPC149680 |
0.6719 | Remote Similarity | NPC259156 |
0.6719 | Remote Similarity | NPC286669 |
0.6719 | Remote Similarity | NPC272125 |
0.6719 | Remote Similarity | NPC242945 |
0.6719 | Remote Similarity | NPC222366 |
0.6719 | Remote Similarity | NPC476039 |
0.6716 | Remote Similarity | NPC474884 |
0.6667 | Remote Similarity | NPC217188 |
0.6667 | Remote Similarity | NPC194586 |
0.6667 | Remote Similarity | NPC67761 |
0.6667 | Remote Similarity | NPC69383 |
0.6667 | Remote Similarity | NPC206906 |
0.6667 | Remote Similarity | NPC180871 |
0.6667 | Remote Similarity | NPC51758 |
0.6667 | Remote Similarity | NPC68889 |
0.6667 | Remote Similarity | NPC473893 |
0.6667 | Remote Similarity | NPC474248 |
0.6667 | Remote Similarity | NPC149668 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC182102 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 |
---|---|---|---|
0.8148 | Intermediate Similarity | NPD4219 | Approved |
0.7636 | Intermediate Similarity | NPD342 | Phase 1 |
0.76 | Intermediate Similarity | NPD4265 | Approved |
0.7167 | Intermediate Similarity | NPD368 | Approved |
0.6667 | Remote Similarity | NPD8264 | Approved |
0.6613 | Remote Similarity | NPD4192 | Approved |
0.6613 | Remote Similarity | NPD4191 | Approved |
0.6613 | Remote Similarity | NPD4193 | Approved |
0.6613 | Remote Similarity | NPD4194 | Approved |
0.6418 | Remote Similarity | NPD6923 | Approved |
0.6418 | Remote Similarity | NPD6922 | Approved |
0.6406 | Remote Similarity | NPD5325 | Clinical (unspecified phase) |
0.6389 | Remote Similarity | NPD7322 | Clinical (unspecified phase) |
0.6327 | Remote Similarity | NPD319 | Phase 1 |
0.6324 | Remote Similarity | NPD7143 | Approved |
0.6324 | Remote Similarity | NPD7144 | Approved |
0.625 | Remote Similarity | NPD5776 | Phase 2 |
0.625 | Remote Similarity | NPD6925 | Approved |
0.6232 | Remote Similarity | NPD7150 | Approved |
0.6232 | Remote Similarity | NPD7152 | Approved |
0.6232 | Remote Similarity | NPD7151 | Approved |
0.6216 | Remote Similarity | NPD7332 | Phase 2 |
0.6216 | Remote Similarity | NPD7514 | Phase 3 |
0.6164 | Remote Similarity | NPD5784 | Clinical (unspecified phase) |
0.6164 | Remote Similarity | NPD7145 | Approved |
0.6133 | Remote Similarity | NPD6902 | Approved |
0.6081 | Remote Similarity | NPD6929 | Approved |
0.6061 | Remote Similarity | NPD2685 | Clinical (unspecified phase) |
0.6056 | Remote Similarity | NPD6924 | Approved |
0.6056 | Remote Similarity | NPD6926 | Approved |
0.6 | Remote Similarity | NPD6931 | Approved |
0.6 | Remote Similarity | NPD4821 | Approved |
0.6 | Remote Similarity | NPD4822 | Approved |
0.6 | Remote Similarity | NPD3210 | Clinical (unspecified phase) |
0.6 | Remote Similarity | NPD6930 | Phase 2 |
0.6 | Remote Similarity | NPD4819 | Approved |
0.6 | Remote Similarity | NPD4820 | Approved |
0.5974 | Remote Similarity | NPD5331 | Approved |
0.5974 | Remote Similarity | NPD7154 | Phase 3 |
0.5974 | Remote Similarity | NPD5332 | Approved |
0.5974 | Remote Similarity | NPD5362 | Discontinued |
0.5972 | Remote Similarity | NPD7339 | Approved |
0.5972 | Remote Similarity | NPD6942 | Approved |
0.5965 | Remote Similarity | NPD4220 | Pre-registration |
0.5965 | Remote Similarity | NPD8262 | Approved |
0.5946 | Remote Similarity | NPD4268 | Approved |
0.5946 | Remote Similarity | NPD4271 | Approved |
0.5938 | Remote Similarity | NPD4246 | Clinical (unspecified phase) |
0.5921 | Remote Similarity | NPD4790 | Discontinued |
0.5921 | Remote Similarity | NPD6898 | Phase 1 |
0.5915 | Remote Similarity | NPD4732 | Discontinued |
0.589 | Remote Similarity | NPD6933 | Approved |
0.5862 | Remote Similarity | NPD2268 | Discontinued |
0.5844 | Remote Similarity | NPD4270 | Approved |
0.5844 | Remote Similarity | NPD4269 | Approved |
0.5811 | Remote Similarity | NPD6932 | Approved |
0.5789 | Remote Similarity | NPD5790 | Clinical (unspecified phase) |
0.5789 | Remote Similarity | NPD4252 | Approved |
0.5769 | Remote Similarity | NPD5783 | Phase 3 |
0.5769 | Remote Similarity | NPD6695 | Phase 3 |
0.5763 | Remote Similarity | NPD6927 | Phase 3 |
0.5735 | Remote Similarity | NPD7331 | Phase 2 |
0.5696 | Remote Similarity | NPD6400 | Clinical (unspecified phase) |
0.5696 | Remote Similarity | NPD7338 | Clinical (unspecified phase) |
0.5676 | Remote Similarity | NPD3701 | Clinical (unspecified phase) |
0.5658 | Remote Similarity | NPD7645 | Phase 2 |
0.5658 | Remote Similarity | NPD6683 | Phase 2 |
0.5625 | Remote Similarity | NPD5363 | Approved |
0.5625 | Remote Similarity | NPD6082 | Clinical (unspecified phase) |
0.5625 | Remote Similarity | NPD6893 | Approved |
PubChem CID   | 5366244 |
ChEMBL   | CHEMBL390773 |
ZINC   |
Molecular Weight:   | 296.31 |
ALogP:   | 1.7816 |
MLogP:   | 3.55 |
XLogP:   | 8.949 |
# Rotatable Bonds:   | 19 |
Polar Surface Area:   | 20.23 |
# H-Bond Aceptor:   | 1 |
# H-Bond Donor:   | 1 |
# Rings:   | 0 |
# Heavy Atoms:   | 21 |