Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AVPR1A | P37288 | 9/20 | 0.46 |
| ▸ | CNR1 | P21554 | 2/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 5/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4363622 | 1.00 | AVPR1A (0.46) | AVPR1ACNR1SIGMAR1DRD4CYP2D6 | |
| SCHEMBL4363467 | 0.91 | AVPR1A (0.47) | AVPR1ACNR1 | |
| SCHEMBL4359913 | 0.91 | AVPR1A (0.47) | AVPR1ACNR1 | |
| SCHEMBL13602998 | 0.90 | AVPR1A (0.47) | AVPR1ACNR1 | |
| SCHEMBL4365594 | 0.88 | AVPR1A (0.49) | AVPR1ACNR1SIGMAR1CYP2D6MEN1 | |
| SCHEMBL4356779 | 0.85 | AVPR1A (0.45) | AVPR1ACNR1 | |
| SCHEMBL4358446 | 0.85 | AVPR1A (0.45) | AVPR1ACNR1 | |
| SCHEMBL4365719 | 0.85 | AVPR1A (0.50) | AVPR1ACNR1 | |
| Hydrochloric Acid SCHEMBL5137245 | 0.84 | AVPR1A (0.49) | AVPR1ACNR1 | |
| Hydrochloric Acid SCHEMBL4358092 | 0.84 | AVPR1A (0.49) | AVPR1ACNR1 |
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-1904477-A1 | INDOL-3-CARBONYL-SPIRO-PIPERIDINE DERIVATIVES AS V1A RECEPTOR ANTAGONISTS | F. Hoffmann-Roche AG (CH) | 2008-04-02 | — | — | EP | disclosed |
| WO-2007006688-A1 | INDOL-3-CARBONYL-SPIRO-PIPERIDINE DERIVATIVES AS V1A RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2007-01-18 | — | — | WO | disclosed |