Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | CTSS | P25774 | 1/20 | 0.31 |
| ▸ | CTSK | P43235 | 1/20 | 0.31 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.31 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.31 |
| ▸ | PER2 | O15055 | 1/20 | 0.31 |
| ▸ | CRY1 | Q16526 | 1/20 | 0.31 |
| ▸ | CRY2 | Q49AN0 | 1/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.31 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | MAOB | P27338 | 1/20 | 0.30 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.30 |
| ▸ | RORC | P51449 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL75648 | 0.87 | ALDH1A1 (0.44) | ALDH1A1TSHRCA2L3MBTL1CTSS | |
| SCHEMBL16486133 | 0.82 | ALDH1A1 (0.38) | ALDH1A1TSHRL3MBTL1CTSSCTSK | |
| SCHEMBL24738201 | 0.78 | OPRM1 (0.44) | ALDH1A1TSHRL3MBTL1AOC3OPRM1 | |
| SCHEMBL14690433 | 0.75 | ALDH1A1 (0.40) | ALDH1A1TSHRCA2L3MBTL1CTSS | |
| SCHEMBL3239387 | 0.69 | ALDH1A1 (0.46) | ALDH1A1TSHRCA2L3MBTL1CTSS | |
| SCHEMBL14691148 | 0.69 | TSHR (0.43) | ALDH1A1TSHRCA2AOC3OPRM1 | |
| SCHEMBL6858801 | 0.66 | ALDH1A1 (0.42) | ALDH1A1TSHRCA2CTSSCTSK | |
| SCHEMBL25354485 | 0.66 | ALDH1A1 (0.39) | ALDH1A1TSHRCA2L3MBTL1CTSS | |
| SCHEMBL14691147 | 0.65 | TSHR (0.39) | ALDH1A1TSHRCA2AOC3OPRM1 | |
| SCHEMBL3241413 | 0.65 | OPRM1 (0.50) | ALDH1A1TSHRCTSSCTSKAOC3 |
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-9670211-B2 | Aza-oxo-indoles for the treatment and prophylaxis of respiratory syncytial virus infection | HOFFMANN-LA ROCHE INC. (US) | 2017-06-06 | — | — | US | disclosed |