Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 12/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 10/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 10/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 8/20 | 0.61 |
| ▸ | THPO | P40225 | 1/20 | 0.61 |
| ▸ | BLM | P54132 | 1/20 | 0.58 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.58 |
| ▸ | CYP2A6 | P11509 | 12/20 | 0.47 |
| ▸ | CYP2E1 | P05181 | 10/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 9/20 | 0.47 |
| ▸ | CYP2B6 | P20813 | 9/20 | 0.47 |
| ▸ | CYP2C8 | P10632 | 6/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | AOC1 | P19801 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2929973 | 0.85 | CYP2C19 (0.56) | CYP2C19CYP2C9CYP1A2CYP3A4THPO | |
| SCHEMBL23122854 | 0.84 | CYP2C19 (0.50) | CYP2C19CYP2C9CYP1A2CYP3A4THPO | |
| SCHEMBL29745157 | 0.84 | CYP2C19 (0.50) | CYP2C19CYP2C9CYP1A2CYP3A4THPO | |
| SCHEMBL8144729 | 0.84 | CYP2C19 (0.55) | CYP2C19CYP2C9CYP1A2CYP3A4THPO | |
| SCHEMBL5175910 | 0.84 | CYP2C19 (0.50) | CYP2C19CYP2C9CYP1A2CYP3A4THPO | |
| SCHEMBL8144728 | 0.84 | CYP2C19 (0.50) | CYP2C19CYP2C9CYP1A2CYP3A4THPO | |
| SCHEMBL7573003 | 0.80 | MEN1 (0.48) | CYP2C19CYP2C9CYP1A2CYP3A4THPO | |
| Hydrochloric Acid SCHEMBL21803707 | 0.79 | BLM (0.48) | CYP2C19CYP2C9CYP1A2CYP3A4THPO | |
| SCHEMBL29745077 | 0.79 | CYP1A2 (0.58) | CYP2C19CYP2C9CYP1A2CYP3A4THPO | |
| SCHEMBL23124208 | 0.79 | CYP1A2 (0.58) | CYP2C19CYP2C9CYP1A2CYP3A4THPO |
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 |
|---|---|---|---|---|---|---|---|
| US-6960588-B1 | Tryptase inhibitors | ALTANA PHARMA AG (DE) | 2005-11-01 | — | — | US | disclosed |
| EP-1216236-A1 | TRYPTASE INHIBITORS | Byk Gulden Lomberg Chemische Fabrik GmbH (DE) | 2002-06-26 | — | — | EP | disclosed |
| WO-2001019809-A1 | TRYPTASE INHIBITORS | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 2001-03-22 | — | — | WO | disclosed |