Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GCGR | P47871 | 16/20 | 0.61 |
| ▸ | GIPR | P48546 | 6/20 | 0.59 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | SNCA | P37840 | 1/20 | 0.40 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.40 |
| ▸ | XDH | P47989 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL12360281 | 0.84 | GCGR (0.81) | GCGRGIPRHDAC1 | |
| SCHEMBL2667415 | 0.83 | GCGR (0.70) | GCGRGIPRHDAC1 | |
| SCHEMBL12360273 | 0.82 | GCGR (0.81) | GCGRGIPRHDAC1 | |
| SCHEMBL12360316 | 0.82 | GCGR (0.70) | GCGRGIPRHDAC1XDH | |
| SCHEMBL2667315 | 0.79 | GCGR (0.41) | GCGRGIPRHDAC1 | |
| SCHEMBL13003176 | 0.78 | GCGR (0.56) | GCGRGIPR | |
| SCHEMBL12360128 | 0.76 | GCGR (1.00) | GCGRGIPR | |
| SCHEMBL2667469 | 0.74 | GCGR (0.56) | GCGRGIPRHDAC1 | |
| SCHEMBL2667297 | 0.74 | GCGR (1.00) | GCGRGIPR | |
| SCHEMBL12360143 | 0.73 | GCGR (1.00) | GCGRGIPR |
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-1590336-B1 | SUBSTITUTED PYRAZOLES, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF USE | MERCK SHARP & DOHME (US) | 2010-12-01 | — | — | EP | disclosed |
| WO-2004069158-A2 | SUBSTITUTED PYRAZOLES, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF USE | MERCK & CO., INC. (US) | 2004-08-19 | — | — | WO | disclosed |