Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 3/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HSD17B3 | P37058 | 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 | |
|---|---|---|---|---|
| SCHEMBL11047401 | 1.00 | APP (0.33) | APPAKR1C3ALDH1A1HSD17B3 | |
| SCHEMBL8547097 | 0.79 | HSD17B3 (0.56) | ALDH1A1HSD17B3 | |
| SCHEMBL11039441 | 0.79 | HSD17B3 (0.56) | ALDH1A1HSD17B3 | |
| SCHEMBL24668284 | 0.76 | AKR1C3 (0.44) | APPAKR1C3ALDH1A1 | |
| SCHEMBL2339963 | 0.76 | CYP2C19 (0.42) | ALDH1A1 | |
| SCHEMBL2339964 | 0.76 | CYP2C19 (0.42) | ALDH1A1 | |
| SCHEMBL1868773 | 0.74 | CYP3A4 (0.33) | — | |
| SCHEMBL11045431 | 0.71 | AHR (0.48) | — | |
| SCHEMBL9163887 | 0.71 | LCK (0.59) | APPALDH1A1 | |
| SCHEMBL9163891 | 0.71 | LCK (0.59) | APPALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4487772-A | CARDIOTONIC AGENTS | OTSUKA PHARMACEUTICAL CO. LTD. (JP) | 1984-12-11 | — | — | US | disclosed |
| US-4468402-A | Carbostyril derivatives, process for producing the same and cardiotonic compositions containing the same | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1984-08-28 | — | — | US | disclosed |
| US-4454130-A | CARDIOTONIC, HYPOTENSIVE AGENTS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1984-06-12 | — | — | US | disclosed |