Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OXTR | P30559 | 5/20 | 0.68 |
| ▸ | AVPR2 | P30518 | 2/20 | 0.68 |
| ▸ | AVPR1A | P37288 | 2/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.68 |
| ▸ | TSHR | P16473 | 1/20 | 0.68 |
| ▸ | MEN1 | O00255 | 2/20 | 0.68 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.68 |
| ▸ | BLM | P54132 | 1/20 | 0.68 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.68 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.68 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.68 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.68 |
| ▸ | AVPR1B | P47901 | 1/20 | 0.65 |
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 | |
|---|---|---|---|---|
| SCHEMBL7278406 | 1.00 | OXTR (0.68) | OXTRAVPR2AVPR1ACYP3A4TSHR | |
| SCHEMBL7278601 | 0.89 | OXTR (0.56) | OXTRAVPR2AVPR1ACYP3A4TSHR | |
| SCHEMBL7278596 | 0.89 | OXTR (0.56) | OXTRAVPR2AVPR1ACYP3A4TSHR | |
| SCHEMBL7302402 | 0.86 | OXTR (0.78) | OXTRAVPR2AVPR1ACYP3A4TSHR | |
| SCHEMBL7286957 | 0.84 | OXTR (0.70) | OXTRAVPR2AVPR1ACYP3A4TSHR | |
| SCHEMBL7287291 | 0.84 | OXTR (0.70) | OXTRAVPR2AVPR1ACYP3A4TSHR | |
| SCHEMBL7304534 | 0.83 | OXTR (0.84) | OXTRAVPR2AVPR1ACYP3A4TSHR | |
| SCHEMBL7303817 | 0.82 | OXTR (0.64) | OXTRAVPR2AVPR1ACYP3A4TSHR | |
| SCHEMBL7305556 | 0.82 | OXTR (0.87) | OXTRAVPR2AVPR1ACYP3A4TSHR | |
| SCHEMBL7311673 | 0.82 | OXTR (0.79) | OXTRAVPR2AVPR1ACYP3A4TSHR |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5686454-A | PREVENTING LABOR, VASODILATION, DIURESIS, HYPOTENSIVE AGENTS, ANTICOAGULANTS, TREATING DYSMENORRHEA | MERCK & CO., INC. (US) | 1997-11-11 | — | — | US | disclosed |
| US-5648352-A | STOPPING LABOR | MERCK & CO., INC. (US) | 1997-07-15 | — | — | US | disclosed |
| EP-0533240-A2 | Substituted amine derivatives of piperazinylcamphorsulfonyl oxytocin antagonists | MERCK & CO. INC. (US) | 1993-03-24 | — | — | EP | disclosed |
| EP-0533242-A2 | Substituted derivatives of piperazinylcamphorsulfonyl oxytocin antagonists | MERCK & CO. INC. (US) | 1993-03-24 | — | — | EP | disclosed |
| EP-0532097-A1 | Piperazinyl(sulfon)amide derivatives of camphor as oxytocin antagonists | MERCK & CO. INC. (US) | 1993-03-17 | — | — | EP | disclosed |