Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT483 | Individual Protein | Prelamin-A/C | Homo sapiens | Potency | = | 6309.6 | nM | PubChem BioAssay data set |
NPT58 | Individual Protein | Bloom syndrome protein | Homo sapiens | Potency | = | 3.2 | nM | PubChem BioAssay data set |
NPT2 | Others | Unspecified | Potency | 23099.9 | nM | PubChem BioAssay data set | ||
NPT101 | Individual Protein | Glucagon-like peptide 1 receptor | Homo sapiens | Potency | 31622.8 | nM | PubChem BioAssay data set | |
NPT73 | Individual Protein | Solute carrier organic anion transporter family member 1B1 | Homo sapiens | Inhibition | = | 113.46 | % | 23571415 |
NPT72 | Individual Protein | Solute carrier organic anion transporter family member 1B3 | Homo sapiens | Inhibition | = | 103.48 | % | 23571415 |
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 NPC98329 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 | NPC7392 |
0.8906 | High Similarity | NPC133758 |
0.8906 | High Similarity | NPC4668 |
0.7879 | Intermediate Similarity | NPC305973 |
0.7681 | Intermediate Similarity | NPC112312 |
0.7639 | Intermediate Similarity | NPC133700 |
0.7108 | Intermediate Similarity | NPC202056 |
0.7013 | Intermediate Similarity | NPC122471 |
0.6761 | Remote Similarity | NPC14437 |
0.6761 | Remote Similarity | NPC270412 |
0.6575 | Remote Similarity | NPC66789 |
0.6351 | Remote Similarity | NPC50047 |
0.6154 | Remote Similarity | NPC87137 |
0.6154 | Remote Similarity | NPC90782 |
0.6044 | Remote Similarity | NPC236322 |
0.5974 | Remote Similarity | NPC314221 |
0.5974 | Remote Similarity | NPC60424 |
0.597 | Remote Similarity | NPC137419 |
0.597 | Remote Similarity | NPC122212 |
0.5851 | Remote Similarity | NPC313265 |
0.5843 | Remote Similarity | NPC296589 |
0.5747 | Remote Similarity | NPC226982 |
0.5747 | Remote Similarity | NPC277341 |
0.5658 | Remote Similarity | NPC273614 |
0.5652 | Remote Similarity | NPC221467 |
0.5645 | Remote Similarity | NPC18188 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC98329 and all drugs/candidates.
●  The right table: Most similar clinical/approved drugs (Tc>=0.56 or Top200).
PubChem CID   | 155107;60209185 |
ChEMBL   | CHEMBL540303 |
ZINC   |
Molecular Weight:   | 127.06 |
ALogP:   | -0.1092 |
MLogP:   | 1.79 |
XLogP:   | -0.388 |
# Rotatable Bonds:   | 2 |
Polar Surface Area:   | 49.33 |
# H-Bond Aceptor:   | 3 |
# H-Bond Donor:   | 2 |
# Rings:   | 1 |
# Heavy Atoms:   | 9 |