Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | PLCG1 | P19174 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL4009144 | 0.79 | NPSR1 (0.77) | NPSR1CYP2C19HTTPLCG1ALDH1A1 | |
| SCHEMBL12341053 | 0.78 | ALDH1A1 (0.45) | HTTGAAALDH1A1KMT2AL3MBTL1 | |
| SCHEMBL3592382 | 0.75 | TDP1 (0.63) | NPSR1CYP2C19HTTGAAALDH1A1 | |
| SCHEMBL492180 | 0.75 | ALDH1A1 (0.39) | NPSR1CYP2C19HTTGAAALDH1A1 | |
| SCHEMBL30484019 | 0.74 | NPSR1 (0.50) | NPSR1CYP2C19GAAPOLBRAB9A | |
| SCHEMBL6887172 | 0.74 | NPSR1 (0.50) | NPSR1CYP2C19GAAPOLBRAB9A | |
| SCHEMBL1970679 | 0.74 | NPSR1 (0.50) | NPSR1CYP2C19GAAALDH1A1L3MBTL1 | |
| SCHEMBL6882245 | 0.73 | NPSR1 (0.49) | NPSR1CYP2C19HTTGAAALDH1A1 | |
| SCHEMBL2747914 | 0.73 | ALDH1A1 (0.57) | HTTGAAALDH1A1KMT2AL3MBTL1 | |
| Hexane SCHEMBL8305527 | 0.72 | NPSR1 (0.66) | NPSR1HTTGAAALDH1A1KMT2A |
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 |