Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LHCGR | P22888 | 1/20 | 0.35 |
| ▸ | FSHR | P23945 | 1/20 | 0.35 |
| ▸ | BRAF | P15056 | 15/20 | 0.34 |
| ▸ | PDE4A | P27815 | 9/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 9/20 | 0.34 |
| ▸ | PDE4C | Q08493 | 9/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 9/20 | 0.34 |
| ▸ | IKBKB | O14920 | 1/20 | 0.31 |
| ▸ | ROCK2 | O75116 | 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 | |
|---|---|---|---|---|
| SCHEMBL3408720 | 0.86 | BRAF (0.35) | BRAFPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL3410905 | 0.86 | BRAF (0.33) | BRAFPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL1176099 | 0.86 | BRAF (0.46) | BRAFPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL3414045 | 0.82 | TGFBR1 (0.37) | BRAFPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL3413417 | 0.81 | BRAF (0.33) | BRAFPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL3411093 | 0.79 | IKBKB (0.34) | LHCGRIKBKB | |
| SCHEMBL3411826 | 0.76 | IKBKB (0.45) | IKBKB | |
| SCHEMBL3408742 | 0.73 | IKBKB (0.40) | IKBKB | |
| SCHEMBL1175986 | 0.72 | BRAF (0.49) | BRAFPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL1176072 | 0.72 | BRAF (0.46) | BRAFPDE4APDE4BPDE4CPDE4D |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2260044-A2 | THIENOPYRIMIDINES | Merck Patent GmbH (DE) | 2010-12-15 | — | — | EP | claimed |
| WO-2009124653-A2 | THIENOPYRIMIDINES | MERCK PATENT GMBH (DE) | 2009-10-15 | — | — | WO | claimed |
| EP-2260044-A2 | THIENOPYRIMIDINES | Merck Patent GmbH (DE) | 2010-12-15 | — | — | EP | disclosed |
| WO-2009124653-A2 | THIENOPYRIMIDINES | MERCK PATENT GMBH (DE) | 2009-10-15 | — | — | WO | disclosed |