Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | CCR3 | P51677 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7727307 | 0.90 | CYP1A2 (0.57) | SLC6A3CYP3A4CYP2D6CYP1A2TSHR | |
| SCHEMBL16333179 | 0.90 | CYP1A2 (0.57) | SLC6A3CYP3A4CYP2D6CYP1A2TSHR | |
| SCHEMBL6478479 | 0.90 | CYP1A2 (0.57) | SLC6A3CYP3A4CYP2D6CYP1A2TSHR | |
| SCHEMBL4063226 | 0.87 | MAPT (0.56) | SLC6A3CYP3A4CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL4061635 | 0.81 | MAPT (0.43) | HRH3SLC6A3CYP3A4CYP2D6SLC6A2 | |
| SCHEMBL8276876 | 0.76 | ALDH1A1 (0.49) | SLC6A3CYP3A4CYP2C19SMN1; SMN2CCR3 | |
| SCHEMBL8784254 | 0.76 | L3MBTL3 (0.58) | CYP3A4CYP2D6CYP1A2TSHRCYP2C19 | |
| SCHEMBL14438305 | 0.76 | CYP1A2 (0.56) | SLC6A3CYP3A4CYP2D6CYP1A2TSHR | |
| SCHEMBL20246717 | 0.75 | SIGMAR1 (0.47) | CYP3A4CYP2D6CYP1A2TSHRCYP2C19 | |
| SCHEMBL18664522 | 0.73 | CYP1A2 (0.57) | HRH3CYP3A4CYP2D6SLC6A2SLC6A4 |
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-2049118-A1 | MORPHOLINYL AND PYRROLIDINYL ANALOGS | SmithKline Beecham Corporation (US) | 2009-04-22 | — | — | EP | disclosed |
| WO-2008011551-A1 | MORPHOLINYL AND PYRROLIDINYL ANALOGS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-01-24 | — | — | WO | disclosed |