Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GCGR | P47871 | 20/20 | 0.72 |
| ▸ | GIPR | P48546 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL2667289 | 0.84 | GCGR (1.00) | GCGRGIPRCYP3A4CYP2C8CYP2C9 | |
| SCHEMBL12360226 | 0.83 | GCGR (0.79) | GCGRGIPRCYP3A4CYP2C8CYP2C9 | |
| SCHEMBL12360221 | 0.80 | GCGR (0.79) | GCGRGIPRCYP3A4CYP2C8CYP2C9 | |
| SCHEMBL12360215 | 0.79 | GCGR (1.00) | GCGRGIPR | |
| SCHEMBL2667457 | 0.76 | GCGR (0.68) | GCGRGIPRCYP3A4CYP2C8CYP2C9 | |
| SCHEMBL12360233 | 0.73 | GCGR (0.87) | GCGRGIPRCYP3A4CYP2C8CYP2C9 | |
| SCHEMBL12360237 | 0.72 | GCGR (0.71) | GCGRGIPRCYP3A4CYP2C8CYP2C9 | |
| SCHEMBL12360131 | 0.71 | GCGR (1.00) | GCGRGIPRCYP3A4CYP2C8CYP2C9 | |
| SCHEMBL9071572 | 0.70 | GCGR (0.64) | GCGRGIPR | |
| SCHEMBL12360236 | 0.69 | GCGR (0.71) | GCGRGIPRCYP3A4CYP2C8CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004069158-A2 | SUBSTITUTED PYRAZOLES, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF USE | MERCK & CO., INC. (US) | 2004-08-19 | — | — | WO | disclosed |