Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | CYP46A1 | Q9Y6A2 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.35 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.34 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29139169 | 1.00 | HTT (0.37) | HTTCYP2C9CYP3A4KMT2AMEN1 | |
| SCHEMBL25359682 | 0.89 | DHODH (0.45) | KDM4EALDH1A1MAPTTDP1DHODH | |
| SCHEMBL30690313 | 0.89 | DHODH (0.45) | KDM4EALDH1A1MAPTTDP1DHODH | |
| SCHEMBL30495146 | 0.86 | DHODH (0.38) | KMT2AMEN1SMN1; SMN2NPSR1GABRA2 | |
| SCHEMBL25359989 | 0.86 | DHODH (0.38) | KMT2AMEN1SMN1; SMN2NPSR1GABRA2 | |
| SCHEMBL25358297 | 0.86 | CYP2C9 (0.42) | HTTCYP2C9CYP3A4KMT2AMEN1 | |
| SCHEMBL30495073 | 0.86 | CYP2C9 (0.42) | HTTCYP2C9CYP3A4KMT2AMEN1 | |
| SCHEMBL25360675 | 0.85 | DHODH (0.32) | CYP2C9KMT2AMEN1KDM4EALDH1A1 | |
| SCHEMBL30494959 | 0.85 | DHODH (0.32) | CYP2C9KMT2AMEN1KDM4EALDH1A1 | |
| SCHEMBL25360103 | 0.83 | PTGS2 (0.39) | — |
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-2024026424-A1 | QUINAZOLINONE DERIVATIVES AS AND RELATED USES | BLACK DIAMOND THERAPEUTICS, INC. (US) | 2024-02-01 | — | — | WO | disclosed |
| CN-117362281-A | PI3K inhibitor and preparation method and application thereof | 海创药业股份有限公司 | 2024-01-09 | — | — | CN | disclosed |