Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.45 |
| ▸ | HRH4 | Q9H3N8 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | THPO | P40225 | 1/20 | 0.45 |
| ▸ | HTR1D | P28221 | 2/20 | 0.44 |
| ▸ | HTR2C | P28335 | 2/20 | 0.44 |
| ▸ | HTR1E | P28566 | 2/20 | 0.44 |
| ▸ | HTR2B | P41595 | 2/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | HTR3A | P46098 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.44 |
| ▸ | CTSB | P07858 | 1/20 | 0.44 |
| ▸ | CTSK | P43235 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28124002 | 0.88 | ITGB2 (0.54) | HRH3HRH4ALDH1A1MEN1GLA | |
| SCHEMBL13912236 | 0.84 | HTR1D (0.49) | HRH3HRH4ALDH1A1MEN1GLA | |
| SCHEMBL28101252 | 0.83 | LNPEP (0.51) | CYP3A4SLC7A5CTSBCTSKSLC15A2 | |
| SCHEMBL5808674 | 0.79 | HTR1D (0.51) | HRH3HRH4HTR1DHTR2CHTR1E | |
| SCHEMBL7598348 | 0.79 | ITGB2 (0.55) | ALDH1A1CYP1A2NFKB1HTR1DHTR2C | |
| SCHEMBL10448000 | 0.78 | REN (0.57) | CTSBCTSKREN | |
| SCHEMBL21828615 | 0.77 | ITGB2 (0.57) | HRH3HRH4ALDH1A1MEN1GLA | |
| SCHEMBL27638943 | 0.77 | ITGB2 (0.57) | HRH3HRH4ALDH1A1MEN1GLA | |
| Bromide SCHEMBL27422846 | 0.77 | REN (0.58) | REN | |
| SCHEMBL23513624 | 0.76 | HTR1D (0.48) | HRH3HRH4ALDH1A1MEN1GLA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0386611-A2 | Amino acid derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1990-09-12 | — | — | EP | disclosed |