Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.34 |
| ▸ | BRAF | P15056 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.32 |
| ▸ | RORC | P51449 | 1/20 | 0.31 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.31 |
| ▸ | AR | P10275 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | CFD | P00746 | 1/20 | 0.30 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3636276 | 0.88 | CFD (0.32) | ARCFD | |
| SCHEMBL3642721 | 0.86 | CYP3A4 (0.38) | CYP3A4DGAT1CYP2C9CYP2C19 | |
| SCHEMBL3023141 | 0.86 | CYP3A4 (0.38) | CYP3A4DGAT1CYP2C9CYP2C19 | |
| SCHEMBL3035875 | 0.86 | CYP3A4 (0.38) | CYP3A4RORCCYP2C9CYP2C19 | |
| SCHEMBL3027622 | 0.86 | CYP3A4 (0.37) | CYP3A4DGAT1CYP2C9CYP2C19 | |
| SCHEMBL3034162 | 0.86 | CYP3A4 (0.37) | CYP3A4DGAT1CYP2C9CYP2C19 | |
| SCHEMBL3016955 | 0.86 | AKR1B1 (0.34) | — | |
| SCHEMBL3033460 | 0.85 | DGAT1 (0.32) | BRAFCYP3A4DGAT1 | |
| SCHEMBL3031153 | 0.84 | CYP3A4 (0.36) | CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL3035911 | 0.84 | CYP3A4 (0.36) | BRAFCYP3A4DGAT1CYP2C9CYP2C19 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8304419-B2 | Chemical compounds | GLAXOSMITHKLINE LLC (US) | 2012-11-06 | — | — | US | disclosed |
| EP-2166856-A1 | CHEMICAL COMPOUNDS | GlaxoSmithKline LLC (US) | 2010-03-31 | — | — | EP | disclosed |
| WO-2008154271-A1 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-12-18 | — | — | WO | disclosed |