Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 14/20 | 0.50 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | TDO2 | P48775 | 2/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.35 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.35 |
| ▸ | BAZ2A | Q9UIF9 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3474857 | 0.83 | GRM2 (0.55) | GRM2TDO2KDM4E | |
| SCHEMBL7822106 | 0.82 | GRM2 (0.56) | GRM2TDO2 | |
| SCHEMBL3474795 | 0.81 | GRM2 (0.62) | GRM2TDO2 | |
| SCHEMBL3475682 | 0.80 | GRM2 (0.50) | GRM2TDO2PTGS2 | |
| SCHEMBL3475834 | 0.80 | GRM2 (0.52) | GRM2TDO2KDM4EALDH1A1RAB9A | |
| SCHEMBL3476566 | 0.80 | GRM2 (0.52) | GRM2TDO2 | |
| SCHEMBL7816041 | 0.79 | GRM2 (0.59) | GRM2TDO2RAB9A | |
| SCHEMBL3477224 | 0.79 | GRM2 (0.53) | GRM2TDO2ALDH1A1 | |
| SCHEMBL3478528 | 0.78 | GRM2 (0.50) | GRM2TDO2KDM4E | |
| SCHEMBL3477068 | 0.78 | GRM2 (0.50) | GRM2TDO2KDM4E |
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 |