Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 6/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.54 |
| ▸ | CFTR | P13569 | 2/20 | 0.51 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8306225 | 0.85 | CYP3A4 (0.45) | ALDH1A1CYP1A2GAACYP2D6CYP2C9 | |
| SCHEMBL30757987 | 0.83 | ALDH1A1 (0.46) | ALDH1A1CYP1A2GAACYP2D6CYP2C9 | |
| SCHEMBL27074582 | 0.83 | ALDH1A1 (0.46) | ALDH1A1CYP1A2GAACYP2D6CYP2C9 | |
| SCHEMBL3428161 | 0.82 | DPP4 (0.61) | ALDH1A1MEN1KMT2AATM | |
| SCHEMBL6797484 | 0.82 | POLB (0.72) | ALDH1A1CYP1A2GAACYP2D6CYP2C9 | |
| SCHEMBL31240990 | 0.81 | CACNA2D1 (0.47) | CYP1A2CYP2D6CYP2C9CYP2C19MEN1 | |
| SCHEMBL12789801 | 0.78 | MEN1 (0.64) | ALDH1A1CYP1A2GAACYP2D6CYP2C9 | |
| SCHEMBL29499010 | 0.78 | NPC1 (0.58) | ALDH1A1CYP1A2GAACYP2D6CYP2C9 | |
| SCHEMBL9954421 | 0.77 | MEN1 (0.51) | ALDH1A1MEN1KMT2APOLBATM | |
| SCHEMBL9954184 | 0.75 | POLB (0.47) | ALDH1A1CYP1A2GAACYP2D6CYP2C9 |
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-2012087938-A1 | QUINAZOLINONE DERIVATIVES AS ANTIVIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2012-06-28 | — | — | WO | disclosed |
| WO-2012087938-A1 | QUINAZOLINONE DERIVATIVES AS ANTIVIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2012-06-28 | — | — | WO | disclosed |