Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 9/20 | 0.62 |
| ▸ | ACHE | P22303 | 7/20 | 0.62 |
| ▸ | BACE1 | P56817 | 7/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | KAT2B | Q92831 | 5/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL13766270 | 1.00 | BCHE (0.62) | BCHEACHEBACE1CYP1A2CYP3A4 | |
| SCHEMBL1781710 | 0.91 | BCHE (0.75) | BCHEACHEBACE1 | |
| SCHEMBL7504191 | 0.91 | BCHE (0.75) | BCHEACHEBACE1 | |
| SCHEMBL1908453 | 0.91 | BCHE (0.75) | BCHEACHEBACE1 | |
| SCHEMBL28511753 | 0.87 | BCHE (0.83) | BCHEACHEBACE1CYP1A2CYP3A4 | |
| SCHEMBL28496734 | 0.87 | BCHE (0.83) | BCHEACHEBACE1CYP1A2CYP3A4 | |
| SCHEMBL27791660 | 0.86 | BCHE (0.54) | BCHEACHEBACE1KAT2B | |
| SCHEMBL350928 | 0.85 | CYP1A2 (0.60) | BCHEACHEBACE1CYP1A2CYP3A4 | |
| SCHEMBL2730825 | 0.85 | CYP1A2 (0.60) | BCHEACHEBACE1CYP1A2CYP3A4 | |
| SCHEMBL6128786 | 0.85 | CYP1A2 (0.60) | BCHEACHEBACE1CYP1A2CYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1255739-A1 | 3-AMINOQUINAZOLIN-2,4-DIONE ANTIBACTERIAL AGENTS | WARNER-LAMBERT COMPANY (US) | 2002-11-13 | — | — | EP | disclosed |
| WO-2001053273-A1 | 3-AMINOQUINAZOLIN-2,4-DIONE ANTIBACTERIAL AGENTS | WARNER-LAMBERT COMPANY (US) | 2001-07-26 | — | — | WO | disclosed |
| US-3980788-A | XANTHENYL COMPOUNDS | SMITHKLINE CORPORATION (US) | 1976-09-14 | — | — | US | disclosed |