Predicted protein targets (top 2)
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL31440601 | 0.91 | NPC1 (0.36) | NPC1DGAT1 | |
| SCHEMBL31440604 | 0.91 | NPC1 (0.36) | NPC1DGAT1 | |
| SCHEMBL20154951 | 0.81 | NPC1 (0.36) | NPC1DGAT1 | |
| SCHEMBL20154958 | 0.81 | NPC1 (0.39) | NPC1DGAT1 | |
| SCHEMBL20155035 | 0.81 | NPC1 (0.36) | NPC1DGAT1 | |
| SCHEMBL20155033 | 0.78 | NPC1 (0.36) | NPC1 | |
| SCHEMBL20154962 | 0.76 | NPC1 (0.33) | NPC1DGAT1 | |
| SCHEMBL20155261 | 0.75 | SMN1; SMN2 (0.35) | NPC1 | |
| SCHEMBL20155010 | 0.73 | DGAT1 (0.40) | NPC1DGAT1 | |
| SCHEMBL20155678 | 0.73 | CHKA (0.33) | NPC1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018086604-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF, AND APPLICATIONS THEREOF | 山东罗欣药业集团股份有限公司 | 2018-05-17 | — | — | WO | disclosed |