Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 11/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 3/20 | 0.33 |
| ▸ | GABRA2 | P47869 | 3/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.33 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
| ▸ | PTAFR | P25105 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL23927198 | 1.00 | P2RX7 (0.39) | P2RX7GABRA1GABRA5GABRA2GABRB2 | |
| SCHEMBL23927185 | 0.90 | P2RX7 (0.43) | P2RX7GABRA1GABRA5GABRA2GABRB2 | |
| SCHEMBL30201943 | 0.90 | P2RX7 (0.43) | P2RX7GABRA1GABRA5GABRA2GABRB2 | |
| SCHEMBL30201991 | 0.89 | P2RX7 (0.35) | P2RX7GABRA1GABRA5GABRA2GABRB2 | |
| SCHEMBL23927170 | 0.89 | P2RX7 (0.35) | P2RX7GABRA1GABRA5GABRA2GABRB2 | |
| SCHEMBL23927163 | 0.89 | P2RX7 (0.42) | P2RX7GABRA1GABRA5GABRA2GABRB2 | |
| SCHEMBL30201992 | 0.89 | P2RX7 (0.42) | P2RX7GABRA1GABRA5GABRA2GABRB2 | |
| SCHEMBL25448187 | 0.88 | GABRA1 (0.36) | P2RX7GABRA1GABRA5GABRA2GABRB2 | |
| SCHEMBL23927133 | 0.88 | P2RX7 (0.41) | P2RX7GABRA1GABRA5GABRA2GABRB2 | |
| SCHEMBL23927175 | 0.88 | GABRA1 (0.37) | P2RX7GABRA1GABRA5GABRA2GABRB2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4139310-A1 | BENZODIAZEPINE DERIVATIVES AS GABA A GAMMA1 PAM | F. Hoffmann-La Roche AG (CH) | 2023-03-01 | — | — | EP | claimed |
| CN-115667262-A | Benzodiazepine derivatives as GABAA γ 1PAM | 豪夫迈·罗氏有限公司 | 2023-01-31 | — | — | CN | claimed |
| EP-4139310-A1 | BENZODIAZEPINE DERIVATIVES AS GABA A GAMMA1 PAM | F. Hoffmann-La Roche AG (CH) | 2023-03-01 | — | — | EP | disclosed |
| CN-115667262-A | Benzodiazepine derivatives as GABAA γ 1PAM | 豪夫迈·罗氏有限公司 | 2023-01-31 | — | — | CN | disclosed |