Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 13/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ATR | Q13535 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3475146 | 0.92 | GRM2 (0.42) | GRM2ALDH1A1KDM4EGAAL3MBTL1 | |
| SCHEMBL3475658 | 0.90 | GRM2 (0.46) | GRM2ALDH1A1KDM4EGAAL3MBTL1 | |
| SCHEMBL3476720 | 0.80 | CNR2 (0.52) | GRM2 | |
| SCHEMBL3475327 | 0.77 | GRM2 (0.46) | GRM2ALDH1A1KDM4EGAALMNA | |
| SCHEMBL13823754 | 0.76 | NPSR1 (0.46) | GRM2 | |
| SCHEMBL3476639 | 0.75 | GRM2 (0.54) | GRM2 | |
| SCHEMBL3474663 | 0.73 | GRM2 (0.42) | GRM2 | |
| SCHEMBL3475353 | 0.73 | GRM2 (0.42) | GRM2KDM4EL3MBTL1 | |
| SCHEMBL3476538 | 0.73 | GRM2 (0.52) | GRM2 | |
| SCHEMBL3476566 | 0.73 | GRM2 (0.52) | GRM2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010141360-A1 | BIARYL BENZOTRIAZOLE DERIVATIVES | MERCK SHARP & DOHME CORP. (US) | 2010-12-09 | — | — | WO | claimed |
| WO-2010141360-A1 | BIARYL BENZOTRIAZOLE DERIVATIVES | MERCK SHARP & DOHME CORP. (US) | 2010-12-09 | — | — | WO | disclosed |
| WO-2010141360-A1 | BIARYL BENZOTRIAZOLE DERIVATIVES | MERCK SHARP & DOHME CORP. (US) | 2010-12-09 | — | — | WO | disclosed |