Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 3/20 | 0.46 |
| ▸ | GABRA5 | P31644 | 3/20 | 0.46 |
| ▸ | GABRA3 | P34903 | 3/20 | 0.46 |
| ▸ | GABRA2 | P47869 | 3/20 | 0.46 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.46 |
| ▸ | MC4R | P32245 | 1/20 | 0.41 |
| ▸ | NISCH | Q9Y2I1 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CTSL | P07711 | 1/20 | 0.34 |
| ▸ | HTR1D | P28221 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1199147 | 0.86 | GABRA1 (0.62) | GABRA1GABRA5GABRA3GABRA2GABRB2 | |
| SCHEMBL28923505 | 0.84 | CHRM1 (0.46) | GABRA1GABRA5GABRA3GABRA2GABRB2 | |
| SCHEMBL30089305 | 0.84 | CHRM1 (0.46) | GABRA1GABRA5GABRA3GABRA2GABRB2 | |
| SCHEMBL1199602 | 0.79 | CHRM1 (0.59) | GABRA1GABRA5GABRA3GABRA2GABRB2 | |
| SCHEMBL18166492 | 0.78 | GABRA1 (0.48) | GABRA1GABRA5GABRA3GABRA2GABRB2 | |
| SCHEMBL28989129 | 0.77 | NISCH (0.38) | MC4RNISCHADRA1A | |
| SCHEMBL30241881 | 0.77 | NISCH (0.38) | MC4RNISCHADRA1A | |
| SCHEMBL23881487 | 0.76 | GABRA1 (0.77) | GABRA1GABRA5GABRA3GABRA2GABRB2 | |
| SCHEMBL30202099 | 0.76 | CHRM1 (0.67) | GABRA1GABRA5GABRA3GABRA2GABRB2 | |
| SCHEMBL30202071 | 0.76 | GABRA1 (0.77) | GABRA1GABRA5GABRA3GABRA2GABRB2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115667262-A | Benzodiazepine derivatives as GABAA γ 1PAM | 豪夫迈·罗氏有限公司 | 2023-01-31 | — | — | CN | disclosed |
| CN-115380034-A | Benzodiazepine derivatives as GABA a γ 1 PAM | 豪夫迈·罗氏有限公司 | 2022-11-22 | — | — | CN | disclosed |