Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | NISCH | Q9Y2I1 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | BRD4 | O60885 | 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 | |
|---|---|---|---|---|
| SCHEMBL11397499 | 1.00 | GAA (0.39) | GAANISCHTSHRMEN1ALDH1A1 | |
| SCHEMBL18321326 | 0.93 | NISCH (0.34) | GAANISCHTSHRMEN1ALDH1A1 | |
| SCHEMBL5471703 | 0.88 | NISCH (0.35) | GAANISCHTSHRMEN1ALDH1A1 | |
| SCHEMBL30051018 | 0.75 | NOS2 (0.39) | GAAMAPT | |
| SCHEMBL11006998 | 0.74 | ADRA2A (0.36) | NISCHTSHRALDH1A1 | |
| SCHEMBL3541131 | 0.74 | NOS2 (0.38) | GAAMAPT | |
| Bromide SCHEMBL7993026 | 0.74 | NOS2 (0.38) | GAAMAPT | |
| SCHEMBL1493703 | 0.69 | GAA (0.35) | GAANISCHTSHRMEN1ALDH1A1 | |
| SCHEMBL18320878 | 0.69 | KCNN1 (0.30) | — | |
| SCHEMBL13444608 | 0.69 | GAA (0.44) | GAANISCHTSHRMEN1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4243585-A | Bendodiazocine derivatives and process of making the same | KALI-CHEMIE AKTIENGESELLSCHAFT (DE) | 1981-01-06 | — | — | US | disclosed |
| US-4243585-A | Bendodiazocine derivatives and process of making the same | KALI-CHEMIE AKTIENGESELLSCHAFT (DE) | 1981-01-06 | — | — | US | disclosed |