Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 3/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.31 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.31 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.31 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.31 |
| ▸ | PDE4A | P27815 | 2/20 | 0.31 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.31 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.31 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL12285120 | 0.79 | TSHR (0.35) | MAPK1CYP3A4CYP2C19ALDH1A1LMNA | |
| SCHEMBL2354325 | 0.76 | ALDH1A1 (0.35) | MAPK1ATMCYP3A4CYP2D6CYP2C19 | |
| SCHEMBL9951376 | 0.75 | ALDH1A1 (0.37) | MAPK1CYP3A4CYP2D6CYP2C19ALDH1A1 | |
| Iodide SCHEMBL28161167 | 0.74 | ALDH1A1 (0.36) | MAPK1CYP3A4CYP2D6CYP2C19ALDH1A1 | |
| Bromide SCHEMBL28286963 | 0.74 | ALDH1A1 (0.36) | MAPK1CYP3A4CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL8738090 | 0.73 | LMNA (0.38) | MAPK1ATMCYP3A4ALDH1A1LMNA | |
| SCHEMBL24442277 | 0.72 | ALDH1A1 (0.35) | MAPK1ATMCYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL24442266 | 0.69 | CA1 (0.33) | MAPK1CYP3A4CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL14094278 | 0.68 | LMNA (0.36) | MAPK1ATMCYP3A4ALDH1A1LMNA | |
| SCHEMBL19590677 | 0.67 | GAA (0.35) | MAPK1ATMCYP3A4CYP2D6CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-7696210-B2 | Gonadotropin releasing hormone receptor antagonists | WYETH (US) | 2010-04-13 | — | — | US | disclosed |