Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OXTR | P30559 | 20/20 | 0.69 |
| ▸ | AVPR1A | P37288 | 3/20 | 0.69 |
| ▸ | AVPR2 | P30518 | 2/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL8089301 | 0.90 | OXTR (0.85) | OXTRAVPR1AAVPR2ALDH1A1 | |
| SCHEMBL7357703 | 0.89 | OXTR (0.82) | OXTRAVPR1AAVPR2ALDH1A1 | |
| SCHEMBL8095049 | 0.88 | OXTR (0.68) | OXTRAVPR1AAVPR2ALDH1A1 | |
| SCHEMBL8081328 | 0.88 | OXTR (0.76) | OXTRAVPR1AAVPR2ALDH1A1 | |
| SCHEMBL8081394 | 0.81 | OXTR (1.00) | OXTRAVPR1AAVPR2ALDH1A1 | |
| SCHEMBL8092959 | 0.81 | OXTR (1.00) | OXTRAVPR1AAVPR2ALDH1A1 | |
| SCHEMBL8088568 | 0.81 | OXTR (0.77) | OXTRAVPR1AAVPR2ALDH1A1 | |
| SCHEMBL8089362 | 0.80 | OXTR (0.69) | OXTRAVPR1AAVPR2ALDH1A1 | |
| SCHEMBL7351827 | 0.80 | OXTR (0.58) | OXTRAVPR1A | |
| SCHEMBL8092986 | 0.80 | OXTR (0.83) | OXTRAVPR1AAVPR2ALDH1A1 |
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-6090805-A | Tocolytic oxytocin receptor antagonists | MERCK & CO., INC. (US) | 2000-07-18 | — | — | US | disclosed |