Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9608683 | 0.89 | EPHX1 (0.39) | TSHR | |
| SCHEMBL10105672 | 0.83 | TSHR (0.36) | TSHRALOX5CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL8242581 | 0.79 | SLC7A5 (0.38) | TSHRALOX5 | |
| SCHEMBL18353906 | 0.76 | MEN1 (0.33) | TSHRALOX5 | |
| SCHEMBL14037712 | 0.75 | TSHR (0.50) | TSHRALOX5 | |
| SCHEMBL27437397 | 0.74 | EPHX1 (0.34) | TSHR | |
| SCHEMBL20313255 | 0.74 | SHBG (0.33) | TSHRALOX5CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL295903 | 0.73 | — | — | |
| SCHEMBL2381945 | 0.73 | EPHX1 (0.40) | TSHR | |
| SCHEMBL30457985 | 0.73 | EPHX1 (0.40) | TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-7449447-B2 | Peptidomimetic NS3-serine protease inhibitors of hepatitis C virus | SCHERING CORPORATION (US) | 2008-11-11 | — | — | US | disclosed |
| WO-2005021584-A2 | NOVEL PEPTIDOMIMETIC NS3-SERINE PROTEASE INHIBITORS OF HEPATITIS C VIRUS | SCHERING CORPORATION (US) | 2005-03-10 | — | — | WO | disclosed |