Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO1797 | Homo sapiens | Species | Hominidae | Eukaryota | saliva |
PMID[24421258] |
||
NPO18932 | Melia azedarach | Species | Meliaceae | Eukaryota | TM-MC* | |||
NPO18932.1 | Melia azedarach var. toosendan | Varieties | Meliaceae | Eukaryota | TM-MC* | |||
NPO26327 | Chaenomeles sinensis | Species | Rosaceae | Eukaryota | TCMID* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT348 | Organism | Myzus persicae | Myzus persicae | LD90 | = | 54.2 | ug/ml | 10995371 |
NPT348 | Organism | Myzus persicae | Myzus persicae | LD50 | = | 39.9 | ug/ml | 10995371 |
NPT2 | Others | Unspecified | Potency | 76958.8 | 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 NPC287782 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 |
---|---|---|
0.8846 | High Similarity | NPC304927 |
0.8846 | High Similarity | NPC289974 |
0.8462 | Intermediate Similarity | NPC164646 |
0.8125 | Intermediate Similarity | NPC218357 |
0.8077 | Intermediate Similarity | NPC133819 |
0.7857 | Intermediate Similarity | NPC59581 |
0.7692 | Intermediate Similarity | NPC37479 |
0.7647 | Intermediate Similarity | NPC69245 |
0.7586 | Intermediate Similarity | NPC100997 |
0.75 | Intermediate Similarity | NPC307594 |
0.7333 | Intermediate Similarity | NPC32279 |
0.7143 | Intermediate Similarity | NPC91093 |
0.6897 | Remote Similarity | NPC227197 |
0.6667 | Remote Similarity | NPC49151 |
0.6667 | Remote Similarity | NPC261991 |
0.6667 | Remote Similarity | NPC262505 |
0.6667 | Remote Similarity | NPC179831 |
0.6667 | Remote Similarity | NPC254713 |
0.6538 | Remote Similarity | NPC1502 |
0.65 | Remote Similarity | NPC106819 |
0.6429 | Remote Similarity | NPC83723 |
0.6364 | Remote Similarity | NPC321646 |
0.6364 | Remote Similarity | NPC21374 |
0.6286 | Remote Similarity | NPC49615 |
0.6286 | Remote Similarity | NPC248190 |
0.6176 | Remote Similarity | NPC228727 |
0.6111 | Remote Similarity | NPC121215 |
0.6071 | Remote Similarity | NPC141986 |
0.6047 | Remote Similarity | NPC22098 |
0.6047 | Remote Similarity | NPC195246 |
0.6047 | Remote Similarity | NPC276009 |
0.6 | Remote Similarity | NPC41007 |
0.6 | Remote Similarity | NPC30338 |
0.6 | Remote Similarity | NPC178643 |
0.6 | Remote Similarity | NPC35371 |
0.6 | Remote Similarity | NPC168714 |
0.5952 | Remote Similarity | NPC114841 |
0.5946 | Remote Similarity | NPC301919 |
0.5938 | Remote Similarity | NPC39869 |
0.5938 | Remote Similarity | NPC276332 |
0.5909 | Remote Similarity | NPC13105 |
0.5862 | Remote Similarity | NPC32603 |
0.5862 | Remote Similarity | NPC222945 |
0.5806 | Remote Similarity | NPC66624 |
0.5789 | Remote Similarity | NPC14608 |
0.5789 | Remote Similarity | NPC252843 |
0.5769 | Remote Similarity | NPC146289 |
0.5758 | Remote Similarity | NPC317739 |
0.5758 | Remote Similarity | NPC52362 |
0.5758 | Remote Similarity | NPC281943 |
0.5714 | Remote Similarity | NPC319680 |
0.5714 | Remote Similarity | NPC147212 |
0.5714 | Remote Similarity | NPC237869 |
0.5714 | Remote Similarity | NPC280532 |
0.5676 | Remote Similarity | NPC316685 |
0.5667 | Remote Similarity | NPC185768 |
0.5667 | Remote Similarity | NPC33928 |
0.5667 | Remote Similarity | NPC254524 |
0.5641 | Remote Similarity | NPC38930 |
0.5641 | Remote Similarity | NPC325454 |
0.5641 | Remote Similarity | NPC223315 |
0.5625 | Remote Similarity | NPC79591 |
0.5625 | Remote Similarity | NPC201132 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC287782 and all drugs/candidates.
●  The right table: Most similar clinical/approved drugs (Tc>=0.56 or Top200).
PubChem CID   | 31245 |
ChEMBL   | CHEMBL2270061 |
ZINC   |
Molecular Weight:   | 100.09 |
ALogP:   | 0.1213 |
MLogP:   | 2.01 |
XLogP:   | 2.018 |
# Rotatable Bonds:   | 5 |
Polar Surface Area:   | 17.07 |
# H-Bond Aceptor:   | 1 |
# H-Bond Donor:   | 0 |
# Rings:   | 0 |
# Heavy Atoms:   | 7 |