Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 1/20 | 0.32 |
| ▸ | DPP4 | P27487 | 2/20 | 0.31 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.31 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29107515 | 0.79 | ACE (0.33) | ACE | |
| SCHEMBL29107688 | 0.78 | ACE (0.32) | ACE | |
| SCHEMBL6327300 | 0.73 | ACE (0.38) | ACE | |
| SCHEMBL10453942 | 0.71 | CYP2D6 (0.44) | ACE | |
| SCHEMBL13104108 | 0.71 | CYP2D6 (0.44) | ACE | |
| SCHEMBL29107614 | 0.69 | CYP2D6 (0.50) | — | |
| SCHEMBL28379100 | 0.69 | CYP2D6 (0.50) | — | |
| SCHEMBL87947 | 0.69 | CYP2D6 (0.50) | — | |
| SCHEMBL4125043 | 0.68 | CYP2D6 (0.49) | — | |
| SCHEMBL10453362 | 0.67 | ACE (0.32) | ACE |
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 |
|---|---|---|---|---|---|---|---|
| CN-116635378-A | Bicyclic 1, 4-diazacycloheptanones and therapeutic uses thereof | 赛特凯恩蒂克公司 | 2023-08-22 | — | — | CN | disclosed |