Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 11/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.31 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.31 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.31 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.31 |
| ▸ | PTGES | O14684 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9896697 | 0.81 | GRM2 (0.37) | GRM2AR | |
| SCHEMBL3474766 | 0.80 | GRM2 (0.39) | GRM2 | |
| SCHEMBL3476240 | 0.80 | GRM2 (0.39) | GRM2 | |
| SCHEMBL3475357 | 0.79 | GRM2 (0.43) | GRM2GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL7883690 | 0.78 | P2RX7 (0.36) | GRM2AR | |
| SCHEMBL3475412 | 0.78 | GRM2 (0.33) | GRM2AR | |
| SCHEMBL3474204 | 0.77 | GRM2 (0.34) | GRM2 | |
| SCHEMBL3476696 | 0.76 | GRM2 (0.37) | GRM2AR | |
| SCHEMBL9895649 | 0.76 | GRM2 (0.35) | GRM2AR | |
| SCHEMBL3475398 | 0.76 | GRM2 (0.33) | GRM2AR |
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 |