Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT176 | Organism | Artemia salina | Artemia salina | LC50 | > | 100 | ug/ml | 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 NPC25237 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 |
---|---|---|
0.7727 | Intermediate Similarity | NPC180402 |
0.7727 | Intermediate Similarity | NPC87359 |
0.7083 | Intermediate Similarity | NPC137327 |
0.7 | Intermediate Similarity | NPC150560 |
0.6889 | Remote Similarity | NPC297220 |
0.6667 | Remote Similarity | NPC327250 |
0.6458 | Remote Similarity | NPC80350 |
0.641 | Remote Similarity | NPC328698 |
0.617 | Remote Similarity | NPC248970 |
0.617 | Remote Similarity | NPC306238 |
0.6122 | Remote Similarity | NPC328378 |
0.6 | Remote Similarity | NPC327239 |
0.6 | Remote Similarity | NPC319175 |
0.6 | Remote Similarity | NPC260324 |
0.6 | Remote Similarity | NPC145895 |
0.5962 | Remote Similarity | NPC321118 |
0.5962 | Remote Similarity | NPC316889 |
0.5918 | Remote Similarity | NPC227850 |
0.5882 | Remote Similarity | NPC318463 |
0.5849 | Remote Similarity | NPC322573 |
0.5814 | Remote Similarity | NPC69179 |
0.5789 | Remote Similarity | NPC254685 |
0.5769 | Remote Similarity | NPC329495 |
0.5741 | Remote Similarity | NPC38463 |
0.5714 | Remote Similarity | NPC319709 |
0.5714 | Remote Similarity | NPC289484 |
0.569 | Remote Similarity | NPC243964 |
0.5686 | Remote Similarity | NPC224624 |
0.5682 | Remote Similarity | NPC111686 |
0.5667 | Remote Similarity | NPC84182 |
0.5667 | Remote Similarity | NPC128005 |
0.5652 | Remote Similarity | NPC241279 |
0.5652 | Remote Similarity | NPC105488 |
0.56 | Remote Similarity | NPC153370 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC25237 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 |
---|---|---|---|
0.7727 | Intermediate Similarity | NPD362 | Phase 1 |
0.7222 | Intermediate Similarity | NPD8613 | Approved |
0.7105 | Intermediate Similarity | NPD8572 | Approved |
0.617 | Remote Similarity | NPD8870 | Approved |
0.6087 | Remote Similarity | NPD9400 | Approved |
0.6087 | Remote Similarity | NPD8869 | Approved |
0.6087 | Remote Similarity | NPD9399 | Approved |
0.6042 | Remote Similarity | NPD379 | Clinical (unspecified phase) |
0.6 | Remote Similarity | NPD329 | Discontinued |
0.5926 | Remote Similarity | NPD583 | Approved |
0.5926 | Remote Similarity | NPD843 | Clinical (unspecified phase) |
0.5926 | Remote Similarity | NPD581 | Approved |
0.5926 | Remote Similarity | NPD584 | Approved |
0.5918 | Remote Similarity | NPD9213 | Approved |
0.5918 | Remote Similarity | NPD9214 | Phase 3 |
0.5849 | Remote Similarity | NPD1830 | Clinical (unspecified phase) |
0.5833 | Remote Similarity | NPD1152 | Phase 2 |
0.5789 | Remote Similarity | NPD8622 | Discontinued |
0.5714 | Remote Similarity | NPD3211 | Approved |
0.566 | Remote Similarity | NPD9419 | Clinical (unspecified phase) |
0.5652 | Remote Similarity | NPD8198 | Approved |
0.5652 | Remote Similarity | NPD8197 | Approved |
0.5625 | Remote Similarity | NPD397 | Phase 2 |
0.56 | Remote Similarity | NPD8614 | Approved |
PubChem CID   | 7408474 |
ChEMBL   | CHEMBL2229111 |
ZINC   |
Molecular Weight:   | 128.06 |
ALogP:   | -0.4708 |
MLogP:   | 1.57 |
XLogP:   | -0.878 |
# Rotatable Bonds:   | 3 |
Polar Surface Area:   | 65.18 |
# H-Bond Aceptor:   | 4 |
# H-Bond Donor:   | 2 |
# Rings:   | 1 |
# Heavy Atoms:   | 9 |