Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.34 |
| ▸ | EPAS1 | Q99814 | 10/20 | 0.33 |
| ▸ | VEGFA | P15692 | 1/20 | 0.33 |
| ▸ | PLG | P00747 | 1/20 | 0.32 |
| ▸ | PLAU | P00749 | 1/20 | 0.32 |
| ▸ | PLAT | P00750 | 1/20 | 0.32 |
| ▸ | HTRA1 | Q92743 | 1/20 | 0.31 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3633795 | 0.93 | CYP3A4 (0.39) | CYP3A4KCNH2EPAS1VEGFAPLG | |
| SCHEMBL3642744 | 0.88 | CYP3A4 (0.41) | CYP3A4KCNH2EPAS1VEGFAHTRA1 | |
| SCHEMBL3637156 | 0.87 | CYP3A4 (0.40) | CYP3A4KCNH2S1PR3EPAS1VEGFA | |
| SCHEMBL3640806 | 0.86 | CYP3A4 (0.45) | CYP3A4KCNH2EPAS1VEGFAPLG | |
| SCHEMBL3633824 | 0.85 | CYP3A4 (0.37) | CYP3A4S1PR3EPAS1 | |
| SCHEMBL3637822 | 0.80 | CYP3A4 (0.37) | CYP3A4EPAS1PLGPLAUPLAT | |
| SCHEMBL3640735 | 0.80 | CYP3A4 (0.38) | CYP3A4S1PR3EPAS1PLGPLAU | |
| SCHEMBL3639405 | 0.79 | CYP3A4 (0.38) | CYP3A4S1PR3EPAS1 | |
| SCHEMBL3639948 | 0.77 | CYP3A4 (0.36) | CYP3A4EPAS1 | |
| SCHEMBL3028109 | 0.77 | CYP3A4 (0.46) | CYP3A4KCNH2EPAS1VEGFASLC22A12 |
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-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 |