Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.30 |
| ▸ | DAO | P14920 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8660892 | 0.94 | CYP1A2 (0.33) | — | |
| SCHEMBL8661601 | 0.91 | HRH3 (0.31) | KCNH2HRH3 | |
| SCHEMBL8659057 | 0.89 | SMN1; SMN2 (0.37) | HRH3 | |
| SCHEMBL8655169 | 0.88 | MAOB (0.35) | GLADAO | |
| SCHEMBL8654817 | 0.85 | HDAC1 (0.33) | — | |
| SCHEMBL8655407 | 0.85 | HTR7 (0.40) | — | |
| SCHEMBL8656718 | 0.84 | TPSAB1 (0.34) | — | |
| SCHEMBL8654695 | 0.84 | HRH3 (0.32) | HRH3 | |
| SCHEMBL8659051 | 0.83 | ACHE (0.33) | GLA | |
| SCHEMBL8661335 | 0.83 | CYP1A2 (0.35) | DAO |
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 |
|---|---|---|---|---|---|---|---|
| US-5776937-A | Adhesion receptor antagonists | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-07-07 | — | — | US | disclosed |