Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AVPR1A | P37288 | 14/20 | 0.80 |
| ▸ | OXTR | P30559 | 1/20 | 0.63 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.49 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.49 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.49 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.49 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.49 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4355431 | 1.00 | AVPR1A (0.80) | AVPR1AOXTRPSEN1PSEN2APH1B | |
| SCHEMBL8242341 | 0.90 | AVPR1A (0.65) | AVPR1AOXTRPSEN1PSEN2APH1B | |
| SCHEMBL4357247 | 0.89 | AVPR1A (0.80) | AVPR1AOXTRPSEN1PSEN2APH1B | |
| SCHEMBL4355499 | 0.89 | AVPR1A (1.00) | AVPR1AOXTRNPY5R | |
| SCHEMBL4364065 | 0.88 | AVPR1A (0.87) | AVPR1AOXTRPSEN1PSEN2APH1B | |
| SCHEMBL4361752 | 0.82 | AVPR1A (0.54) | AVPR1AOXTRNPY5R | |
| SCHEMBL4361754 | 0.82 | AVPR1A (0.54) | AVPR1AOXTRNPY5R | |
| SCHEMBL4369121 | 0.81 | AVPR1A (0.54) | AVPR1AOXTRNPY5R | |
| SCHEMBL4365900 | 0.81 | AVPR1A (0.76) | AVPR1AOXTRPSEN1PSEN2APH1B | |
| SCHEMBL4369124 | 0.81 | AVPR1A (0.54) | AVPR1AOXTRNPY5R |
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 | claimed |
| WO-2007006688-A1 | INDOL-3-CARBONYL-SPIRO-PIPERIDINE DERIVATIVES AS V1A RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2007-01-18 | — | — | WO | claimed |