Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO13539 | Thuja occidentalis | Species | Cupressaceae | Eukaryota | HerDing* | |||
NPO7591 | Cedrus deodara | Species | Pinaceae | Eukaryota | TCMID* | |||
NPO15294 | Magnolia salicifolia | Species | Magnoliaceae | Eukaryota | HerDing* | |||
NPO27751 | Pinus radiata | Species | Pinaceae | Eukaryota | TCMID* | |||
NPO17494 | Prunella vulgaris | Species | Lamiaceae | Eukaryota | HerDing* | |||
NPO20553 | Zingiber officinale | Species | Zingiberaceae | Eukaryota | TCMID* | |||
NPO20553 | Zingiber officinale | Species | Zingiberaceae | Eukaryota | HerDing* | |||
NPO15294 | Magnolia salicifolia | Species | Magnoliaceae | Eukaryota | TCMID* | |||
NPO24816 | Anaphalis contorta | Species | Asteraceae | Eukaryota | HerDing* | |||
NPO26589 | Artemisia annua | Species | Asteraceae | Eukaryota | HerDing* | |||
NPO27751 | Pinus radiata | Species | Pinaceae | Eukaryota | HerDing* | |||
NPO28295 | Foeniculum vulgare | Species | Apiaceae | Eukaryota | HerDing* | |||
NPO30036 | Chenopodium botrys | Species | Chenopodiaceae | Eukaryota | HerDing* | |||
NPO30851 | Magnolia liliflora | Species | Magnoliaceae | Eukaryota | HerDing* | |||
NPO31384 | Thuja orientalis | Species | Cupressaceae | Eukaryota | HerDing* | |||
NPO6316 | Abies balsamea | Species | Pinaceae | Eukaryota | HerDing* | |||
NPO6741 | Metasequoia glyptostroboides | Species | Cupressaceae | Eukaryota | HerDing* | |||
NPO2978 | Croton tiglium | Species | Euphorbiaceae | Eukaryota | TM-MC* | |||
NPO22741 | Curcuma kwangsiensis | Species | Zingiberaceae | Eukaryota | TM-MC* | |||
NPO18068 | Curcuma phaeocaulis | Species | Zingiberaceae | Eukaryota | TM-MC* | |||
NPO2618 | Curcuma wenyujin | Species | Zingiberaceae | Eukaryota | TM-MC* | |||
NPO7929 | Curcuma zedoaria | Species | Zingiberaceae | Eukaryota | TM-MC* | |||
NPO7698 | Elettaria cardamomum | Species | Zingiberaceae | Eukaryota | TM-MC* | |||
NPO28295 | Foeniculum vulgare | Species | Apiaceae | Eukaryota | TM-MC* | |||
NPO5241 | Myristica fragrans | Species | Myristicaceae | Eukaryota | TM-MC* | |||
NPO17494 | Prunella vulgaris | Species | Lamiaceae | Eukaryota | TCMID* | |||
NPO28295 | Foeniculum vulgare | Species | Apiaceae | Eukaryota | TCMID* | |||
NPO2048 | Rhizoma curcumae | NA | NA | NA | TCMID* | |||
NPO22014 | Dysphania botrys | Species | Chenopodiaceae | Eukaryota | TCMID* | |||
NPO6316 | Abies balsamea | Species | Pinaceae | Eukaryota | TCMID* | |||
NPO26589 | Artemisia annua | Species | Asteraceae | Eukaryota | TCMID* | |||
NPO6741 | Metasequoia glyptostroboides | Species | Cupressaceae | Eukaryota | TCMID* | |||
NPO13539 | Thuja occidentalis | Species | Cupressaceae | Eukaryota | TCMID* | |||
NPO28256 | Platycladus orientalis | Species | Cupressaceae | Eukaryota | TCMID* | |||
NPO24816 | Anaphalis contorta | Species | Asteraceae | Eukaryota | TCMID* | |||
NPO13730 | Magnolia liliiflora | Species | Magnoliaceae | Eukaryota | 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 NPC29976 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 | NPC150713 |
0.9623 | High Similarity | NPC89069 |
0.9623 | High Similarity | NPC166894 |
0.9623 | High Similarity | NPC283655 |
0.9623 | High Similarity | NPC277917 |
0.9623 | High Similarity | NPC178223 |
0.8197 | Intermediate Similarity | NPC249078 |
0.8197 | Intermediate Similarity | NPC236099 |
0.8197 | Intermediate Similarity | NPC209686 |
0.8103 | Intermediate Similarity | NPC3025 |
0.807 | Intermediate Similarity | NPC202146 |
0.807 | Intermediate Similarity | NPC32222 |
0.8033 | Intermediate Similarity | NPC83088 |
0.8033 | Intermediate Similarity | NPC95804 |
0.8033 | Intermediate Similarity | NPC185547 |
0.7846 | Intermediate Similarity | NPC474756 |
0.7812 | Intermediate Similarity | NPC44122 |
0.7778 | Intermediate Similarity | NPC118937 |
0.7778 | Intermediate Similarity | NPC159654 |
0.7778 | Intermediate Similarity | NPC281540 |
0.7778 | Intermediate Similarity | NPC167995 |
0.7759 | Intermediate Similarity | NPC53209 |
0.7742 | Intermediate Similarity | NPC148174 |
0.7742 | Intermediate Similarity | NPC71460 |
0.7742 | Intermediate Similarity | NPC218585 |
0.7727 | Intermediate Similarity | NPC477820 |
0.7705 | Intermediate Similarity | NPC230070 |
0.7705 | Intermediate Similarity | NPC9880 |
0.7705 | Intermediate Similarity | NPC87828 |
0.7692 | Intermediate Similarity | NPC74885 |
0.7692 | Intermediate Similarity | NPC308522 |
0.7692 | Intermediate Similarity | NPC63190 |
0.7681 | Intermediate Similarity | NPC131584 |
0.7681 | Intermediate Similarity | NPC313185 |
0.7681 | Intermediate Similarity | NPC139765 |
0.7667 | Intermediate Similarity | NPC291147 |
0.7656 | Intermediate Similarity | NPC473276 |
0.7656 | Intermediate Similarity | NPC41577 |
0.7656 | Intermediate Similarity | NPC474380 |
0.7619 | Intermediate Similarity | NPC114891 |
0.7612 | Intermediate Similarity | NPC251201 |
0.7612 | Intermediate Similarity | NPC232925 |
0.7612 | Intermediate Similarity | NPC63588 |
0.7581 | Intermediate Similarity | NPC66145 |
0.7538 | Intermediate Similarity | NPC142712 |
0.75 | Intermediate Similarity | NPC69149 |
0.746 | Intermediate Similarity | NPC147524 |
0.7455 | Intermediate Similarity | NPC147343 |
0.7455 | Intermediate Similarity | NPC287550 |
0.7455 | Intermediate Similarity | NPC176309 |
0.7455 | Intermediate Similarity | NPC84030 |
0.7455 | Intermediate Similarity | NPC198540 |
0.7455 | Intermediate Similarity | NPC223468 |
0.7424 | Intermediate Similarity | NPC48079 |
0.7424 | Intermediate Similarity | NPC475884 |
0.7424 | Intermediate Similarity | NPC473230 |
0.7419 | Intermediate Similarity | NPC475968 |
0.7391 | Intermediate Similarity | NPC14352 |
0.7391 | Intermediate Similarity | NPC153719 |
0.7391 | Intermediate Similarity | NPC234527 |
0.7391 | Intermediate Similarity | NPC470610 |
0.7385 | Intermediate Similarity | NPC243469 |
0.7385 | Intermediate Similarity | NPC190827 |
0.7385 | Intermediate Similarity | NPC475943 |
0.7333 | Intermediate Similarity | NPC471269 |
0.7313 | Intermediate Similarity | NPC472741 |
0.7286 | Intermediate Similarity | NPC477508 |
0.7286 | Intermediate Similarity | NPC304499 |
0.7286 | Intermediate Similarity | NPC48795 |
0.7286 | Intermediate Similarity | NPC309178 |
0.7286 | Intermediate Similarity | NPC475458 |
0.726 | Intermediate Similarity | NPC329871 |
0.726 | Intermediate Similarity | NPC269333 |
0.7258 | Intermediate Similarity | NPC476735 |
0.7231 | Intermediate Similarity | NPC219940 |
0.7206 | Intermediate Similarity | NPC241085 |
0.7206 | Intermediate Similarity | NPC66407 |
0.7206 | Intermediate Similarity | NPC129829 |
0.7206 | Intermediate Similarity | NPC470830 |
0.7206 | Intermediate Similarity | NPC299948 |
0.7206 | Intermediate Similarity | NPC254037 |
0.7206 | Intermediate Similarity | NPC107919 |
0.7183 | Intermediate Similarity | NPC317242 |
0.7162 | Intermediate Similarity | NPC117137 |
0.7162 | Intermediate Similarity | NPC66766 |
0.7143 | Intermediate Similarity | NPC95958 |
0.7121 | Intermediate Similarity | NPC472946 |
0.7121 | Intermediate Similarity | NPC300442 |
0.7101 | Intermediate Similarity | NPC192192 |
0.7101 | Intermediate Similarity | NPC282454 |
0.7101 | Intermediate Similarity | NPC231945 |
0.7097 | Intermediate Similarity | NPC236588 |
0.7097 | Intermediate Similarity | NPC135438 |
0.7097 | Intermediate Similarity | NPC119425 |
0.7083 | Intermediate Similarity | NPC163597 |
0.7083 | Intermediate Similarity | NPC470145 |
0.7 | Intermediate Similarity | NPC131506 |
0.7 | Intermediate Similarity | NPC157777 |
0.7 | Intermediate Similarity | NPC111234 |
0.7 | Intermediate Similarity | NPC109457 |
0.7 | Intermediate Similarity | NPC478103 |
0.7 | Intermediate Similarity | NPC187471 |
0.7 | Intermediate Similarity | NPC252182 |
0.7 | Intermediate Similarity | NPC100586 |
0.7 | Intermediate Similarity | NPC470071 |
0.7 | Intermediate Similarity | NPC473279 |
0.7 | Intermediate Similarity | NPC195530 |
0.7 | Intermediate Similarity | NPC127094 |
0.7 | Intermediate Similarity | NPC1340 |
0.7 | Intermediate Similarity | NPC157422 |
0.6986 | Remote Similarity | NPC477227 |
0.6986 | Remote Similarity | NPC302578 |
0.6986 | Remote Similarity | NPC128951 |
0.6986 | Remote Similarity | NPC476233 |
0.6986 | Remote Similarity | NPC192046 |
0.6986 | Remote Similarity | NPC185915 |
0.6986 | Remote Similarity | NPC105208 |
0.6957 | Remote Similarity | NPC321732 |
0.6957 | Remote Similarity | NPC324607 |
0.6949 | Remote Similarity | NPC307022 |
0.6944 | Remote Similarity | NPC270306 |
0.6944 | Remote Similarity | NPC91387 |
0.6944 | Remote Similarity | NPC231680 |
0.6901 | Remote Similarity | NPC473238 |
0.6901 | Remote Similarity | NPC310766 |
0.6901 | Remote Similarity | NPC232112 |
0.6901 | Remote Similarity | NPC201373 |
0.6901 | Remote Similarity | NPC472341 |
0.6897 | Remote Similarity | NPC95969 |
0.6897 | Remote Similarity | NPC127997 |
0.6892 | Remote Similarity | NPC42853 |
0.6892 | Remote Similarity | NPC67657 |
0.6892 | Remote Similarity | NPC18857 |
0.6892 | Remote Similarity | NPC477819 |
0.6892 | Remote Similarity | NPC471045 |
0.6892 | Remote Similarity | NPC477817 |
0.6883 | Remote Similarity | NPC69953 |
0.6883 | Remote Similarity | NPC29342 |
0.6883 | Remote Similarity | NPC2572 |
0.6866 | Remote Similarity | NPC477009 |
0.6866 | Remote Similarity | NPC165069 |
0.6866 | Remote Similarity | NPC238352 |
0.6857 | Remote Similarity | NPC133873 |
0.6857 | Remote Similarity | NPC254845 |
0.6857 | Remote Similarity | NPC45296 |
0.6818 | Remote Similarity | NPC290791 |
0.6818 | Remote Similarity | NPC292419 |
0.6806 | Remote Similarity | NPC192638 |
0.6806 | Remote Similarity | NPC25511 |
0.6806 | Remote Similarity | NPC145552 |
0.6806 | Remote Similarity | NPC10476 |
0.6806 | Remote Similarity | NPC5046 |
0.6806 | Remote Similarity | NPC62657 |
0.6806 | Remote Similarity | NPC192501 |
0.6806 | Remote Similarity | NPC49168 |
0.6806 | Remote Similarity | NPC478130 |
0.6806 | Remote Similarity | NPC228994 |
0.6806 | Remote Similarity | NPC196358 |
0.6806 | Remote Similarity | NPC254509 |
0.68 | Remote Similarity | NPC287452 |
0.68 | Remote Similarity | NPC49627 |
0.68 | Remote Similarity | NPC1319 |
0.68 | Remote Similarity | NPC49599 |
0.6795 | Remote Similarity | NPC242016 |
0.6774 | Remote Similarity | NPC45387 |
0.6769 | Remote Similarity | NPC84218 |
0.6761 | Remote Similarity | NPC156277 |
0.6761 | Remote Similarity | NPC320549 |
0.6761 | Remote Similarity | NPC127283 |
0.6761 | Remote Similarity | NPC89310 |
0.6761 | Remote Similarity | NPC151018 |
0.6761 | Remote Similarity | NPC58057 |
0.6761 | Remote Similarity | NPC8004 |
0.6761 | Remote Similarity | NPC164045 |
0.6757 | Remote Similarity | NPC133596 |
0.6757 | Remote Similarity | NPC307336 |
0.6757 | Remote Similarity | NPC474574 |
0.6757 | Remote Similarity | NPC138502 |
0.6757 | Remote Similarity | NPC260301 |
0.6757 | Remote Similarity | NPC64081 |
0.6757 | Remote Similarity | NPC171658 |
0.6757 | Remote Similarity | NPC11907 |
0.6753 | Remote Similarity | NPC470611 |
0.6753 | Remote Similarity | NPC296734 |
0.6753 | Remote Similarity | NPC475388 |
0.6721 | Remote Similarity | NPC36002 |
0.6721 | Remote Similarity | NPC102336 |
0.6719 | Remote Similarity | NPC162685 |
0.6719 | Remote Similarity | NPC47663 |
0.6719 | Remote Similarity | NPC87296 |
0.6719 | Remote Similarity | NPC475515 |
0.6719 | Remote Similarity | NPC215671 |
0.6716 | Remote Similarity | NPC101128 |
0.6714 | Remote Similarity | NPC131892 |
0.6714 | Remote Similarity | NPC99264 |
0.6714 | Remote Similarity | NPC6120 |
0.6714 | Remote Similarity | NPC213178 |
0.6714 | Remote Similarity | NPC327728 |
0.6712 | Remote Similarity | NPC212879 |
0.6712 | Remote Similarity | NPC185536 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC29976 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 |
---|---|---|---|
0.7455 | Intermediate Similarity | NPD385 | Approved |
0.7455 | Intermediate Similarity | NPD384 | Approved |
0.7353 | Intermediate Similarity | NPD4787 | Phase 1 |
0.7213 | Intermediate Similarity | NPD586 | Phase 1 |
0.7206 | Intermediate Similarity | NPD4267 | Clinical (unspecified phase) |
0.6957 | Remote Similarity | NPD3698 | Phase 2 |
0.6866 | Remote Similarity | NPD3171 | Clinical (unspecified phase) |
0.6857 | Remote Similarity | NPD4244 | Approved |
0.6857 | Remote Similarity | NPD4245 | Approved |
0.6761 | Remote Similarity | NPD4808 | Clinical (unspecified phase) |
0.6761 | Remote Similarity | NPD4809 | Clinical (unspecified phase) |
0.6714 | Remote Similarity | NPD3699 | Clinical (unspecified phase) |
0.6714 | Remote Similarity | NPD3700 | Clinical (unspecified phase) |
0.6711 | Remote Similarity | NPD6928 | Phase 2 |
0.6622 | Remote Similarity | NPD6117 | Approved |
0.6575 | Remote Similarity | NPD6113 | Clinical (unspecified phase) |
0.6533 | Remote Similarity | NPD6116 | Phase 1 |
0.6494 | Remote Similarity | NPD4748 | Discontinued |
0.6486 | Remote Similarity | NPD3703 | Phase 2 |
0.6447 | Remote Similarity | NPD6115 | Approved |
0.6447 | Remote Similarity | NPD6697 | Approved |
0.6447 | Remote Similarity | NPD6114 | Approved |
0.6447 | Remote Similarity | NPD6118 | Approved |
0.64 | Remote Similarity | NPD3701 | Clinical (unspecified phase) |
0.6389 | Remote Similarity | NPD4789 | Approved |
0.6364 | Remote Similarity | NPD3198 | Approved |
0.6338 | Remote Similarity | NPD6705 | Phase 1 |
0.6282 | Remote Similarity | NPD7525 | Registered |
0.6267 | Remote Similarity | NPD6942 | Approved |
0.6267 | Remote Similarity | NPD3702 | Approved |
0.6267 | Remote Similarity | NPD7339 | Approved |
0.6111 | Remote Similarity | NPD5360 | Phase 3 |
0.6111 | Remote Similarity | NPD5361 | Clinical (unspecified phase) |
0.6081 | Remote Similarity | NPD4243 | Approved |
0.6026 | Remote Similarity | NPD3671 | Phase 1 |
0.5921 | Remote Similarity | NPD6926 | Approved |
0.5921 | Remote Similarity | NPD4785 | Approved |
0.5921 | Remote Similarity | NPD6924 | Approved |
0.5921 | Remote Similarity | NPD4784 | Approved |
0.5904 | Remote Similarity | NPD7520 | Clinical (unspecified phase) |
0.5867 | Remote Similarity | NPD5777 | Approved |
0.5867 | Remote Similarity | NPD4758 | Discontinued |
0.5854 | Remote Similarity | NPD4788 | Approved |
0.5844 | Remote Similarity | NPD5275 | Approved |
0.5844 | Remote Similarity | NPD4190 | Phase 3 |
0.5833 | Remote Similarity | NPD4224 | Phase 2 |
0.5833 | Remote Similarity | NPD388 | Approved |
0.5833 | Remote Similarity | NPD386 | Approved |
0.5811 | Remote Similarity | NPD6922 | Approved |
0.5811 | Remote Similarity | NPD6923 | Approved |
0.5795 | Remote Similarity | NPD4202 | Approved |
0.5795 | Remote Similarity | NPD8171 | Discontinued |
0.5783 | Remote Similarity | NPD3665 | Phase 1 |
0.5783 | Remote Similarity | NPD3666 | Approved |
0.5783 | Remote Similarity | NPD3133 | Approved |
0.5775 | Remote Similarity | NPD371 | Approved |
0.5769 | Remote Similarity | NPD6933 | Approved |
0.5765 | Remote Similarity | NPD4751 | Clinical (unspecified phase) |
0.5738 | Remote Similarity | NPD343 | Approved |
0.5738 | Remote Similarity | NPD344 | Approved |
0.5738 | Remote Similarity | NPD345 | Approved |
0.5733 | Remote Similarity | NPD7144 | Approved |
0.5733 | Remote Similarity | NPD7143 | Approved |
0.5658 | Remote Similarity | NPD7151 | Approved |
0.5658 | Remote Similarity | NPD7150 | Approved |
0.5658 | Remote Similarity | NPD7152 | Approved |
0.5658 | Remote Similarity | NPD6081 | Approved |
0.5647 | Remote Similarity | NPD3618 | Phase 1 |
0.5632 | Remote Similarity | NPD5328 | Approved |
PubChem CID   | 6997371 |
ChEMBL   | CHEMBL3188732 |
ZINC   |
Molecular Weight:   | 154.14 |
ALogP:   | 1.0088 |
MLogP:   | 2.45 |
XLogP:   | 2.312 |
# Rotatable Bonds:   | 4 |
Polar Surface Area:   | 20.23 |
# H-Bond Aceptor:   | 1 |
# H-Bond Donor:   | 1 |
# Rings:   | 2 |
# Heavy Atoms:   | 11 |