Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 3/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4971480 | 0.89 | — | — | |
| SCHEMBL4971484 | 0.89 | — | — | |
| SCHEMBL4969899 | 0.88 | HTR2C (0.30) | — | |
| SCHEMBL4969906 | 0.88 | HTR2C (0.30) | — | |
| SCHEMBL4971591 | 0.79 | ALDH1A1 (0.33) | CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL4969001 | 0.78 | MEN1 (0.30) | — | |
| SCHEMBL4969715 | 0.77 | MEN1 (0.43) | — | |
| SCHEMBL1866462 | 0.72 | CTSK (0.34) | CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL1866461 | 0.72 | CTSK (0.34) | CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL499255 | 0.72 | CTSK (0.36) | — |
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-1966139-A1 | ASPARTIC PROTEASE INHIBITORS | Vitae Pharmaceuticals, Inc. (US) | 2008-09-10 | — | — | EP | disclosed |
| WO-2007070201-A1 | ASPARTIC PROTEASE INHIBITORS | VITAE PHARMACEUTICALS, INC. (US) | 2007-06-21 | — | — | WO | disclosed |