Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 5/20 | 0.43 |
| ▸ | MAOB | P27338 | 2/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.36 |
| ▸ | LIG1 | P18858 | 1/20 | 0.36 |
| ▸ | RORC | P51449 | 2/20 | 0.36 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.36 |
| ▸ | HSD11B2 | P80365 | 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 | |
|---|---|---|---|---|
| SCHEMBL4573447 | 0.90 | MAOB (0.43) | SLC6A3SLC6A4SLC6A2HSD11B1MAOB | |
| SCHEMBL2775554 | 0.75 | DPP4 (0.46) | SLC6A3SLC6A4SLC6A2 | |
| SCHEMBL19093772 | 0.73 | ESR1 (0.60) | SLC6A3SLC6A4SLC6A2HSD11B1MAOB | |
| SCHEMBL723224 | 0.73 | GRIN2D (0.47) | SLC6A3SLC6A4SLC6A2 | |
| Ammonia Solution, Strong SCHEMBL27575342 | 0.71 | SLC6A3 (0.48) | SLC6A3SLC6A4SLC6A2HSD11B1MAOB | |
| SCHEMBL13361601 | 0.71 | SLC6A3 (0.48) | SLC6A3SLC6A4SLC6A2HSD11B1MAOB | |
| SCHEMBL2780627 | 0.71 | SLC6A3 (0.53) | SLC6A3 | |
| SCHEMBL9037762 | 0.71 | SLC6A3 (0.48) | SLC6A3SLC6A4SLC6A2HSD11B1MAOB | |
| SCHEMBL6154699 | 0.71 | OPRM1 (0.50) | SLC6A3SLC6A4SLC6A2HSD11B1 | |
| SCHEMBL7262204 | 0.71 | SLC6A3 (0.53) | SLC6A3SLC6A4SLC6A2HSD11B1HDAC3 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6200993-B1 | ASTHMA; ANTIINFLAMMATORY AGENTS | MERCK FROSST CANADA & CO. (CA) | 2001-03-13 | — | — | US | disclosed |