Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL11371451 | 1.00 | ALDH1A1 (0.46) | ALDH1A1CYP2C19USP2TSHR | |
| SCHEMBL7759366 | 1.00 | ALDH1A1 (0.46) | ALDH1A1CYP2C19USP2TSHR | |
| SCHEMBL11245376 | 0.97 | — | — | |
| SCHEMBL27386312 | 0.78 | — | — | |
| SCHEMBL26556808 | 0.78 | — | — | |
| SCHEMBL11247629 | 0.75 | JAK2 (0.30) | — | |
| SCHEMBL11238388 | 0.75 | — | — | |
| SCHEMBL11250288 | 0.75 | — | — | |
| SCHEMBL9014795 | 0.74 | ALDH1A1 (0.35) | ALDH1A1CYP2C19USP2TSHR | |
| SCHEMBL27651887 | 0.74 | CYP2C19 (0.35) | ALDH1A1CYP2C19USP2TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-0001900-B1 | 9-THIA-12-AZAPROSTANOIC ACID DERIVATIVES AND COMPOSITIONS CONTAINING THEM | MERCK & CO. INC. (US) | 1982-04-07 | — | — | EP | disclosed |
| US-4225609-A | Interphenylene 9-thia-11-oxo-12-aza-prostanoic acids | MERCK & CO., INC. (US) | 1980-09-30 | — | — | US | disclosed |
| EP-0001900-A1 | 9-Thia-12-azaprostanoic acid derivatives and compositions containing them | MERCK & CO. INC. (US) | 1979-05-16 | — | — | EP | disclosed |