Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 8/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 8/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 7/20 | 0.46 |
| ▸ | PNMT | P11086 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | TDO2 | P48775 | 1/20 | 0.39 |
| ▸ | IDO2 | Q6ZQW0 | 1/20 | 0.39 |
| ▸ | AHR | P35869 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4038103 | 0.84 | SLC6A4 (0.47) | SLC6A3SLC6A4SLC6A2PNMTKCNH2 | |
| SCHEMBL12498162 | 0.84 | SLC6A2 (0.48) | SLC6A3SLC6A4SLC6A2PNMTALDH1A1 | |
| SCHEMBL13910093 | 0.84 | SLC6A4 (0.47) | SLC6A3SLC6A4SLC6A2PNMTKCNH2 | |
| SCHEMBL13778646 | 0.84 | SLC6A4 (0.47) | SLC6A3SLC6A4SLC6A2PNMTKCNH2 | |
| SCHEMBL16649569 | 0.81 | SLC6A2 (0.46) | SLC6A3SLC6A4SLC6A2PNMTKCNH2 | |
| SCHEMBL27228890 | 0.81 | SLC6A2 (0.46) | SLC6A3SLC6A4SLC6A2PNMTKCNH2 | |
| SCHEMBL16649385 | 0.81 | PNMT (0.43) | SLC6A3SLC6A4SLC6A2PNMTKCNH2 | |
| SCHEMBL10603418 | 0.81 | PNMT (0.43) | SLC6A3SLC6A4SLC6A2PNMTKCNH2 | |
| SCHEMBL16649256 | 0.81 | PNMT (0.43) | SLC6A3SLC6A4SLC6A2PNMTKCNH2 | |
| SCHEMBL16649650 | 0.80 | SLC6A4 (0.51) | SLC6A3SLC6A4SLC6A2KCNH2ALDH1A1 |
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-0709376-B1 | Phenylpiperidino derivatives as neurokinin antagonists | ASTRAZENECA AB (SE) | 2003-07-23 | — | — | EP | disclosed |
| US-6008223-A | ANTIINFLAMMATORY AGENTS FOR TREATING ASTHMA | ZENECA LIMITED (GB) | 1999-12-28 | — | — | US | disclosed |
| US-5731309-A | Substituted heteroalkyleneamine neurokinin antagonists | ZENECA LIMITED (GB) | 1998-03-24 | — | — | US | disclosed |
| EP-0709376-A2 | Therapeutic compounds | ZENECA LIMITED (GB) | 1996-05-01 | — | — | EP | disclosed |