Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OXTR | P30559 | 6/20 | 0.53 |
| ▸ | AVPR1A | P37288 | 6/20 | 0.53 |
| ▸ | AVPR2 | P30518 | 2/20 | 0.53 |
| ▸ | CD274 | Q9NZQ7 | 14/20 | 0.46 |
| ▸ | PDCD1 | Q15116 | 5/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL931120 | 0.93 | OXTR (0.52) | OXTRAVPR1AAVPR2CD274PDCD1 | |
| SCHEMBL931030 | 0.84 | OXTR (0.61) | OXTRAVPR1AAVPR2CD274 | |
| SCHEMBL930550 | 0.80 | OXTR (0.80) | OXTRAVPR1AAVPR2 | |
| SCHEMBL930956 | 0.78 | OXTR (0.41) | OXTRAVPR1AAVPR2 | |
| SCHEMBL5121875 | 0.74 | OXTR (0.60) | OXTRAVPR1AAVPR2 | |
| SCHEMBL6532411 | 0.73 | OXTR (0.69) | OXTRAVPR1AAVPR2 | |
| SCHEMBL931377 | 0.73 | OXTR (0.80) | OXTRAVPR1AAVPR2 | |
| SCHEMBL931016 | 0.70 | OXTR (0.69) | OXTRAVPR1AAVPR2 | |
| SCHEMBL8279842 | 0.70 | OXTR (0.42) | OXTRAVPR1AAVPR2 | |
| SCHEMBL930950 | 0.70 | OXTR (1.00) | OXTRAVPR1AAVPR2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1673355-A1 | SUBSTITUTED TRIAZOLE DERIVATIVES AS OXYTOCIN ANTAGONISTS | Pfizer Limited (GB) | 2006-06-28 | — | — | EP | disclosed |
| WO-2005028452-A1 | SUBSTITUTED TRIAZOLE DERIVATIVES AS OXYTOCIN ANTAGONISTS | PFIZER LIMITED (GB) | 2005-03-31 | — | — | WO | disclosed |