Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO12011 | Crataegus pinnatifida | Species | Rosaceae | Eukaryota | HerDing* | |||
NPO16741 | Codonopsis pilosula | Species | Campanulaceae | Eukaryota | HerDing* | |||
NPO489 | Codonopsis radix | Species | Campanulaceae | Eukaryota | TCMSP* | |||
NPO12011 | Crataegus pinnatifida | Species | Rosaceae | Eukaryota | TCMID* | |||
NPO16741 | Codonopsis pilosula | Species | Campanulaceae | Eukaryota | TCMID* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT208 | Individual Protein | Cytochrome P450 1A2 | Homo sapiens | IC50 | = | 55000 | nM | 15916432 |
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 NPC27501 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 | NPC14312 |
0.8077 | Intermediate Similarity | NPC133792 |
0.8077 | Intermediate Similarity | NPC7777 |
0.8 | Intermediate Similarity | NPC172053 |
0.6818 | Remote Similarity | NPC82648 |
0.6818 | Remote Similarity | NPC278711 |
0.6818 | Remote Similarity | NPC227986 |
0.6818 | Remote Similarity | NPC136996 |
0.6818 | Remote Similarity | NPC64370 |
0.6818 | Remote Similarity | NPC302327 |
0.6818 | Remote Similarity | NPC273385 |
0.6667 | Remote Similarity | NPC59846 |
0.6667 | Remote Similarity | NPC252008 |
0.6522 | Remote Similarity | NPC89422 |
0.6364 | Remote Similarity | NPC224874 |
0.6364 | Remote Similarity | NPC110911 |
0.625 | Remote Similarity | NPC77249 |
0.625 | Remote Similarity | NPC154477 |
0.625 | Remote Similarity | NPC26974 |
0.625 | Remote Similarity | NPC239406 |
0.625 | Remote Similarity | NPC26229 |
0.5946 | Remote Similarity | NPC78551 |
0.5946 | Remote Similarity | NPC59570 |
0.5946 | Remote Similarity | NPC45270 |
0.5946 | Remote Similarity | NPC227632 |
0.5946 | Remote Similarity | NPC215118 |
0.5946 | Remote Similarity | NPC62086 |
0.5946 | Remote Similarity | NPC135077 |
0.5909 | Remote Similarity | NPC98925 |
0.5833 | Remote Similarity | NPC139717 |
0.5833 | Remote Similarity | NPC152459 |
0.5833 | Remote Similarity | NPC297643 |
0.5833 | Remote Similarity | NPC229262 |
0.5789 | Remote Similarity | NPC103290 |
0.5714 | Remote Similarity | NPC328441 |
0.5641 | Remote Similarity | NPC105246 |
0.5641 | Remote Similarity | NPC190232 |
0.5641 | Remote Similarity | NPC193180 |
0.5625 | Remote Similarity | NPC321646 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC27501 and all drugs/candidates.
●  The right table: Most similar clinical/approved drugs (Tc>=0.56 or Top200).
PubChem CID   | 15506 |
ChEMBL   | CHEMBL192820 |
ZINC   |
Molecular Weight:   | 140.16 |
ALogP:   | -0.928 |
MLogP:   | 2.56 |
XLogP:   | 5.629 |
# Rotatable Bonds:   | 4 |
Polar Surface Area:   | 0 |
# H-Bond Aceptor:   | 0 |
# H-Bond Donor:   | 0 |
# Rings:   | 1 |
# Heavy Atoms:   | 10 |