Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 7/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 10/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 8/20 | 0.55 |
| ▸ | USP2 | O75604 | 7/20 | 0.55 |
| ▸ | CLK4 | Q9HAZ1 | 7/20 | 0.55 |
| ▸ | LMNA | P02545 | 6/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.54 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.54 |
| ▸ | TSHR | P16473 | 5/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL4184316 | 0.99 | IRAK4 (0.57) | IRAK4CYP1A2CYP3A4USP2CLK4 | |
| SCHEMBL4177504 | 0.89 | IRAK4 (0.60) | IRAK4CYP1A2CYP3A4USP2CLK4 | |
| Hydrochloric Acid SCHEMBL4187802 | 0.88 | IRAK4 (0.59) | IRAK4CYP1A2CYP3A4USP2CLK4 | |
| SCHEMBL4185275 | 0.88 | CYP1A2 (0.59) | IRAK4CYP1A2CYP3A4USP2CLK4 | |
| SCHEMBL4177899 | 0.87 | CYP1A2 (0.61) | IRAK4CYP1A2CYP3A4USP2CLK4 | |
| SCHEMBL4170358 | 0.86 | IRAK4 (0.56) | IRAK4CYP1A2CYP3A4USP2CLK4 | |
| SCHEMBL4188262 | 0.85 | CYP1A2 (0.59) | IRAK4CYP1A2CYP3A4USP2CLK4 | |
| SCHEMBL4177424 | 0.85 | IRAK4 (0.60) | IRAK4CYP1A2CYP3A4USP2CLK4 | |
| SCHEMBL4170949 | 0.84 | IRAK4 (0.56) | IRAK4CYP1A2CYP3A4USP2CLK4 | |
| SCHEMBL4178986 | 0.84 | CYP1A2 (0.56) | IRAK4CYP1A2CYP3A4USP2CLK4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1996562-A1 | SUBSTITUTED 4-AMINO-QUINAZOLINE DERIVATIVES AS REGULATORS OF METABOTROPIC GLUTAMATE RECEPTORS AND THEIR USE FOR PRODUCING DRUGS | Grünenthal GmbH (DE) | 2008-12-03 | — | — | EP | claimed |
| WO-2007104560-A1 | SUBSTITUTED 4-AMINO-QUINAZOLINE DERIVATIVES AS REGULATORS OF METABOTROPIC GLUTAMATE RECEPTORS AND THEIR USE FOR PRODUCING DRUGS | Grünenthal GmbH (DE) | 2007-09-20 | — | — | WO | claimed |