Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 5/20 | 0.47 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.47 |
| ▸ | CSF1R | P07333 | 1/20 | 0.47 |
| ▸ | RET | P07949 | 1/20 | 0.47 |
| ▸ | FLT4 | P35916 | 1/20 | 0.47 |
| ▸ | ABL2 | P42684 | 1/20 | 0.47 |
| ▸ | BLK | P51451 | 1/20 | 0.47 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.47 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.47 |
| ▸ | AVPR2 | P30518 | 8/20 | 0.44 |
| ▸ | AVPR1A | P37288 | 7/20 | 0.44 |
| ▸ | AKT1 | P31749 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8562449 | 0.90 | AVPR2 (0.46) | AURKAAURKBAVPR2AVPR1A | |
| SCHEMBL8561948 | 0.88 | AVPR2 (0.51) | AVPR2AVPR1A | |
| SCHEMBL8561230 | 0.87 | AVPR1A (0.46) | AVPR2AVPR1A | |
| SCHEMBL8559885 | 0.86 | AVPR2 (0.46) | AURKAAURKBAVPR2AVPR1A | |
| SCHEMBL8558194 | 0.85 | AKT1 (0.52) | AURKAAKT1 | |
| SCHEMBL8558577 | 0.85 | AVPR2 (0.57) | AVPR2AVPR1A | |
| SCHEMBL8557851 | 0.84 | MAPT (0.48) | AURKARETAVPR2AVPR1AAKT1 | |
| SCHEMBL8556942 | 0.83 | NPC1 (0.49) | AURKAAURKB | |
| SCHEMBL8557883 | 0.83 | MEN1 (0.50) | AVPR2AVPR1AAKT1 | |
| SCHEMBL8562616 | 0.83 | ITGB1 (0.40) | AVPR2AVPR1AAKT1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0640592-B1 | N-acylated tricyclic azaheterorings useful as vasopressin antagonists | AMERICAN CYANAMID CO (US) | 1998-12-30 | — | — | EP | disclosed |