Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 13/20 | 0.62 |
| ▸ | SLC6A4 | P31645 | 13/20 | 0.62 |
| ▸ | SLC6A3 | Q01959 | 10/20 | 0.62 |
| ▸ | UGT2B7 | P16662 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.46 |
| ▸ | AKT1 | P31749 | 1/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.44 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.44 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.44 |
| ▸ | HTR3A | P46098 | 2/20 | 0.44 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.44 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.44 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28596057 | 0.88 | UGT2B7 (0.55) | SLC6A2SLC6A4SLC6A3UGT2B7KCNH2 | |
| SCHEMBL13576627 | 0.82 | SLC6A2 (0.48) | SLC6A2SLC6A4SLC6A3UGT2B7KCNH2 | |
| SCHEMBL13576638 | 0.82 | SLC6A2 (0.48) | SLC6A2SLC6A4SLC6A3UGT2B7KCNH2 | |
| SCHEMBL11356021 | 0.81 | SLC6A4 (0.58) | SLC6A2SLC6A4SLC6A3UGT2B7KCNH2 | |
| Hydrochloric Acid SCHEMBL11359827 | 0.79 | SLC6A4 (0.59) | SLC6A2SLC6A4SLC6A3UGT2B7KCNH2 | |
| SCHEMBL4812150 | 0.79 | SLC6A2 (0.57) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL20883793 | 0.79 | SLC6A2 (0.67) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL13476481 | 0.79 | SLC6A4 (0.63) | SLC6A2SLC6A4SLC6A3AKT1 | |
| Bromide SCHEMBL11850319 | 0.78 | SLC6A2 (0.56) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL13476484 | 0.77 | SLC6A2 (0.69) | SLC6A2SLC6A4SLC6A3KCNH2AKT1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010016554-A1 | CYCLIC AMINE COMPOUND | 武田薬品工業株式会社 (JP) | 2010-02-11 | — | — | WO | disclosed |
| US-6265434-B1 | ANTIINFLAMMATORY AGENTS | MERCK & CO., INC. | 2001-07-24 | — | — | US | disclosed |