Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO29588 | Ganoderma | Genus | Ganodermataceae | Eukaryota | TCMSP* | |||
NPO22273 | Angelica pubescens | Species | Apiaceae | Eukaryota | TCMID* | |||
NPO17331 | Radix clematidis | Species | Lymnaeidae | Eukaryota | TCMSP* | |||
NPO29700 | Peucedani radix | NA | NA | NA | TCMSP* | |||
NPO17506 | Semen pharbitidis | NA | NA | NA | TCMSP* | |||
NPO24731 | Sesami nigrum semen | NA | NA | NA | TCMSP* | |||
NPO13103 | Radix angelicae biseratae | Species | Lymnaeidae | Eukaryota | TCMSP* | |||
NPO2203 | Flos genkwa | Species | Lycaenidae | Eukaryota | TCMSP* | |||
NPO2921 | Angelica acutiloba | Species | Apiaceae | Eukaryota | TM-MC* | |||
NPO1436 | Houttuynia cordata | Species | Saururaceae | Eukaryota | TCM_Taiwan* | |||
NPO11438 | Angelica gigas | Species | Apiaceae | Eukaryota | TM-MC* | |||
NPO1797 | Homo sapiens | Species | Hominidae | Eukaryota | Faeces |
PMID[23454028] |
||
NPO15462 | Angelica sinensis | Species | Apiaceae | Eukaryota | TM-MC* | |||
NPO1797 | Homo sapiens | Species | Hominidae | Eukaryota | saliva |
PMID[24421258] |
||
NPO6583 | Clematis chinensis | Species | Ranunculaceae | Eukaryota | TM-MC* | |||
NPO20553 | Zingiber officinale | Species | Zingiberaceae | Eukaryota | TCM_Taiwan* | |||
NPO10868 | Clematis hexapetala | Species | Ranunculaceae | Eukaryota | TM-MC* | |||
NPO20553 | Zingiber officinale | Species | Zingiberaceae | Eukaryota | HerDing* | |||
NPO16314.1 | Clematis terniflora var. mandshurica | Varieties | Ranunculaceae | Eukaryota | TM-MC* | |||
NPO22273 | Angelica pubescens | Species | Apiaceae | Eukaryota | TCM_Taiwan* | |||
NPO9693 | Clematis manshurica | Species | Ranunculaceae | Eukaryota | TM-MC* | |||
NPO1436 | Houttuynia cordata | Species | Saururaceae | Eukaryota | TM-MC* | |||
NPO22273 | Angelica pubescens | Species | Apiaceae | Eukaryota | HerDing* | |||
NPO13879 | Humulus lupulus | Species | Cannabaceae | Eukaryota | TM-MC* | |||
NPO24758 | Angelica dahurica | Species | Apiaceae | Eukaryota | HerDing* | |||
NPO4391 | Hypericum perforatum | Species | Hypericaceae | Eukaryota | TM-MC* | |||
NPO31003 | Moschus sifanicus | Species | Moschidae | Eukaryota | HerDing* | |||
NPO29463 | Pogostemon cablin | Species | Lamiaceae | Eukaryota | TM-MC* | |||
NPO11495 | Pellia epiphylla | Species | Pelliaceae | Eukaryota | UNPD* | |||
NPO20553 | Zingiber officinale | Species | Zingiberaceae | Eukaryota | TCMID* | |||
NPO14835 | Lepraria chlorina | Species | Stereocaulaceae | Eukaryota | UNPD* | |||
NPO21963 | Hypericum japonicum | Species | Hypericaceae | Eukaryota | TCMID* | |||
NPO14674 | Vallesia glabra | Species | Apocynaceae | Eukaryota | UNPD* | |||
NPO13599 | Dryopteris abbreviata | Species | Dryopteridaceae | Eukaryota | UNPD* | |||
NPO2646 | Moschus moschiferus | Species | Moschidae | Eukaryota | TCMID* | |||
NPO15446 | Quercus coccifera | Species | Fagaceae | Eukaryota | UNPD* | |||
NPO463 | Moschus berezovskii | Species | Moschidae | Eukaryota | TCMID* | |||
NPO8387 | Lactarius flavidulus | Species | Lactariidae | Eukaryota | UNPD* | |||
NPO12246 | Moschus chrysogaster | Species | Moschidae | Eukaryota | TCMID* | |||
NPO12500 | Inga umbellifera | Species | Fabaceae | Eukaryota | UNPD* | |||
NPO11411 | Gossypium herbaceum | Species | Malvaceae | Eukaryota | TCMID* | |||
NPO5174 | Helenium mexicanum | Species | Asteraceae | Eukaryota | UNPD* | |||
NPO24758 | Angelica dahurica | Species | Apiaceae | Eukaryota | TCMID* | |||
NPO11328 | Juniperus chinensis | Species | Cupressaceae | Eukaryota | UNPD* | |||
NPO25628 | Abrus pulchellus | Species | Fabaceae | Eukaryota | TCMID* | |||
NPO13468.1 | Cryptomeria japonica var. sinensis | Varieties | Cupressaceae | Eukaryota | UNPD* | |||
NPO1771 | Rose rugosae flos | NA | NA | NA | TCMSP* | |||
NPO20568 | Hyperici japonici herber | NA | NA | NA | TCMSP* | |||
NPO32 | Peucedanidecursivi radix | NA | NA | NA | TCMSP* | |||
NPO914 | Smilacis glabrae rhixoma | NA | NA | NA | TCMSP* | |||
NPO29579 | Arisaematis rhizoma | NA | NA | NA | TCMSP* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT210 | Individual Protein | Thyroid stimulating hormone receptor | Homo sapiens | Potency | = | 3162.3 | nM | PubChem BioAssay data set |
NPT347 | Cell Line | Lymphoblastoid cells | Homo sapiens | Potency | = | 19952.6 | nM | PubChem BioAssay data set |
NPT2 | Others | Unspecified | Potency | 1126.1 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 245.4 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 10962.2 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 15355.3 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 63322.9 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 68589.6 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 44829.2 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 1263.5 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 70407.2 | 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 NPC227986 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 | NPC278711 |
1.0 | High Similarity | NPC302327 |
1.0 | High Similarity | NPC82648 |
1.0 | High Similarity | NPC136996 |
1.0 | High Similarity | NPC273385 |
1.0 | High Similarity | NPC64370 |
0.9375 | High Similarity | NPC89422 |
0.9333 | High Similarity | NPC224874 |
0.8824 | High Similarity | NPC154477 |
0.8824 | High Similarity | NPC77249 |
0.8824 | High Similarity | NPC239406 |
0.8824 | High Similarity | NPC26974 |
0.8824 | High Similarity | NPC26229 |
0.8667 | High Similarity | NPC98925 |
0.75 | Intermediate Similarity | NPC234888 |
0.75 | Intermediate Similarity | NPC127355 |
0.7333 | Intermediate Similarity | NPC150271 |
0.7143 | Intermediate Similarity | NPC47161 |
0.6818 | Remote Similarity | NPC14312 |
0.6818 | Remote Similarity | NPC27501 |
0.6667 | Remote Similarity | NPC187095 |
0.6522 | Remote Similarity | NPC172053 |
0.6522 | Remote Similarity | NPC287807 |
0.625 | Remote Similarity | NPC266539 |
0.625 | Remote Similarity | NPC256060 |
0.625 | Remote Similarity | NPC29199 |
0.625 | Remote Similarity | NPC31891 |
0.625 | Remote Similarity | NPC266144 |
0.625 | Remote Similarity | NPC287191 |
0.5882 | Remote Similarity | NPC236495 |
0.5833 | Remote Similarity | NPC38513 |
0.5833 | Remote Similarity | NPC88325 |
0.5769 | Remote Similarity | NPC313882 |
0.5769 | Remote Similarity | NPC295442 |
0.5769 | Remote Similarity | NPC223195 |
0.5769 | Remote Similarity | NPC76765 |
0.5769 | Remote Similarity | NPC179103 |
0.5714 | Remote Similarity | NPC252008 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC227986 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 |
---|---|---|---|
NPD |
PubChem CID   | 8141 |
ChEMBL   | CHEMBL335900 |
ZINC   |
Molecular Weight:   | 128.16 |
ALogP:   | -1.9134 |
MLogP:   | 2.45 |
XLogP:   | 5.461 |
# Rotatable Bonds:   | 8 |
Polar Surface Area:   | 0 |
# H-Bond Aceptor:   | 0 |
# H-Bond Donor:   | 0 |
# Rings:   | 0 |
# Heavy Atoms:   | 9 |