Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO420 | Eucheuma muricatum | Species | Solieriaceae | Eukaryota | TCMID* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT152 | Individual Protein | Nuclear factor erythroid 2-related factor 2 | Homo sapiens | Potency | 33491.5 | nM | PubChem BioAssay data set | |
NPT103 | Individual Protein | Nuclear receptor ROR-gamma | Homo sapiens | Potency | 334.9 | nM | PubChem BioAssay data set | |
NPT153 | Individual Protein | Androgen Receptor | Homo sapiens | Potency | 482.1 | nM | PubChem BioAssay data set | |
NPT2 | Others | Unspecified | Potency | 24541.2 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 68101.6 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 42163.2 | nM | PubChem BioAssay data set | ||
NPT163 | Individual Protein | Nuclear factor NF-kappa-B p105 subunit | Homo sapiens | Potency | 1.2 | nM | PubChem BioAssay data set | |
NPT74 | Individual Protein | Proto-oncogene c-JUN | Homo sapiens | Potency | 54544.6 | nM | PubChem BioAssay data set | |
NPT163 | Individual Protein | Nuclear factor NF-kappa-B p105 subunit | Homo sapiens | Potency | 61644.8 | nM | PubChem BioAssay data set | |
NPT2 | Others | Unspecified | Potency | 2169 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 30419.9 | 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 NPC119076 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 |
---|---|---|
0.9298 | High Similarity | NPC18259 |
0.8983 | High Similarity | NPC134584 |
0.7818 | Intermediate Similarity | NPC11150 |
0.75 | Intermediate Similarity | NPC200624 |
0.7258 | Intermediate Similarity | NPC320749 |
0.6933 | Remote Similarity | NPC67863 |
0.6719 | Remote Similarity | NPC56072 |
0.6719 | Remote Similarity | NPC149436 |
0.6719 | Remote Similarity | NPC277704 |
0.6709 | Remote Similarity | NPC125549 |
0.6615 | Remote Similarity | NPC269586 |
0.6615 | Remote Similarity | NPC198841 |
0.6515 | Remote Similarity | NPC469807 |
0.6515 | Remote Similarity | NPC300345 |
0.6515 | Remote Similarity | NPC212114 |
0.6515 | Remote Similarity | NPC65873 |
0.6515 | Remote Similarity | NPC120441 |
0.6418 | Remote Similarity | NPC114327 |
0.6418 | Remote Similarity | NPC8235 |
0.6418 | Remote Similarity | NPC36357 |
0.6395 | Remote Similarity | NPC322888 |
0.6341 | Remote Similarity | NPC33756 |
0.6341 | Remote Similarity | NPC38459 |
0.6324 | Remote Similarity | NPC147062 |
0.6324 | Remote Similarity | NPC169110 |
0.6324 | Remote Similarity | NPC147578 |
0.6235 | Remote Similarity | NPC240134 |
0.6232 | Remote Similarity | NPC310758 |
0.6232 | Remote Similarity | NPC150196 |
0.6232 | Remote Similarity | NPC45255 |
0.6232 | Remote Similarity | NPC248705 |
0.6232 | Remote Similarity | NPC210849 |
0.6232 | Remote Similarity | NPC238023 |
0.6232 | Remote Similarity | NPC54368 |
0.6232 | Remote Similarity | NPC135924 |
0.6232 | Remote Similarity | NPC246588 |
0.6176 | Remote Similarity | NPC64270 |
0.6143 | Remote Similarity | NPC66517 |
0.6143 | Remote Similarity | NPC71009 |
0.6143 | Remote Similarity | NPC200745 |
0.6143 | Remote Similarity | NPC29680 |
0.6143 | Remote Similarity | NPC22786 |
0.6056 | Remote Similarity | NPC113670 |
0.6056 | Remote Similarity | NPC21211 |
0.6056 | Remote Similarity | NPC88566 |
0.6056 | Remote Similarity | NPC50266 |
0.6056 | Remote Similarity | NPC22627 |
0.6023 | Remote Similarity | NPC174048 |
0.5972 | Remote Similarity | NPC32312 |
0.5972 | Remote Similarity | NPC291066 |
0.5972 | Remote Similarity | NPC198023 |
0.5972 | Remote Similarity | NPC155172 |
0.589 | Remote Similarity | NPC36440 |
0.589 | Remote Similarity | NPC178527 |
0.5833 | Remote Similarity | NPC45756 |
0.5811 | Remote Similarity | NPC267443 |
0.5811 | Remote Similarity | NPC6107 |
0.5811 | Remote Similarity | NPC52330 |
0.5806 | Remote Similarity | NPC316435 |
0.5733 | Remote Similarity | NPC181786 |
0.5733 | Remote Similarity | NPC78954 |
0.5733 | Remote Similarity | NPC311343 |
0.5733 | Remote Similarity | NPC82770 |
0.5733 | Remote Similarity | NPC239931 |
0.5714 | Remote Similarity | NPC149263 |
0.5676 | Remote Similarity | NPC289915 |
0.5676 | Remote Similarity | NPC113837 |
0.5658 | Remote Similarity | NPC473206 |
0.5658 | Remote Similarity | NPC246822 |
0.5658 | Remote Similarity | NPC98880 |
0.5658 | Remote Similarity | NPC139416 |
0.5658 | Remote Similarity | NPC235059 |
0.5658 | Remote Similarity | NPC213570 |
0.5658 | Remote Similarity | NPC200936 |
0.5658 | Remote Similarity | NPC16190 |
0.5658 | Remote Similarity | NPC5324 |
0.5658 | Remote Similarity | NPC169222 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC119076 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 |
---|---|---|---|
0.7432 | Intermediate Similarity | NPD914 | Suspended |
0.7067 | Intermediate Similarity | NPD1475 | Approved |
0.6721 | Remote Similarity | NPD9072 | Clinical (unspecified phase) |
0.6709 | Remote Similarity | NPD1185 | Approved |
0.6627 | Remote Similarity | NPD913 | Clinical (unspecified phase) |
0.6582 | Remote Similarity | NPD9302 | Approved |
0.65 | Remote Similarity | NPD262 | Approved |
0.65 | Remote Similarity | NPD9303 | Approved |
0.65 | Remote Similarity | NPD5288 | Clinical (unspecified phase) |
0.65 | Remote Similarity | NPD263 | Approved |
0.6395 | Remote Similarity | NPD9251 | Approved |
0.6341 | Remote Similarity | NPD9073 | Approved |
0.6322 | Remote Similarity | NPD912 | Approved |
0.6056 | Remote Similarity | NPD675 | Discontinued |
0.6047 | Remote Similarity | NPD9249 | Phase 1 |
0.6047 | Remote Similarity | NPD9077 | Approved |
0.6044 | Remote Similarity | NPD9482 | Approved |
0.6044 | Remote Similarity | NPD9480 | Approved |
0.6044 | Remote Similarity | NPD9481 | Approved |
0.5972 | Remote Similarity | NPD173 | Clinical (unspecified phase) |
0.5851 | Remote Similarity | NPD9722 | Approved |
0.5851 | Remote Similarity | NPD9721 | Approved |
0.5714 | Remote Similarity | NPD2656 | Approved |
0.5714 | Remote Similarity | NPD2655 | Approved |
0.5663 | Remote Similarity | NPD472 | Approved |
0.5658 | Remote Similarity | NPD9497 | Clinical (unspecified phase) |
0.5652 | Remote Similarity | NPD234 | Approved |
0.5638 | Remote Similarity | NPD3097 | Clinical (unspecified phase) |
PubChem CID   | 10943 |
ChEMBL   | CHEMBL45235 |
ZINC   |
Molecular Weight:   | 145.97 |
ALogP:   | 1.4886 |
MLogP:   | 1.9 |
XLogP:   | 2.988 |
# Rotatable Bonds:   | 2 |
Polar Surface Area:   | 0 |
# H-Bond Aceptor:   | 0 |
# H-Bond Donor:   | 0 |
# Rings:   | 1 |
# Heavy Atoms:   | 8 |