Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.52 |
| ▸ | TRPV4 | Q9HBA0 | 2/20 | 0.32 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17182450 | 0.85 | CYP2A6 (0.46) | CYP2A6 | |
| SCHEMBL17182542 | 0.85 | CYP2A6 (0.46) | CYP2A6 | |
| SCHEMBL20559975 | 0.76 | CYP2A6 (0.58) | CYP2A6GPR35 | |
| SCHEMBL1995148 | 0.73 | CYP2A6 (0.71) | CYP2A6GPR35 | |
| SCHEMBL15888126 | 0.71 | CYP2A6 (0.52) | CYP2A6GPR35 | |
| SCHEMBL12321281 | 0.71 | CYP2A6 (0.52) | CYP2A6GPR35 | |
| SCHEMBL6014124 | 0.69 | CYP2A6 (0.60) | CYP2A6GPR35 | |
| SCHEMBL11550694 | 0.69 | CYP2A6 (0.60) | CYP2A6 | |
| SCHEMBL846924 | 0.68 | CYP2A6 (1.00) | CYP2A6GPR35 | |
| SCHEMBL21688675 | 0.68 | CYP2A6 (0.58) | CYP2A6 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0906301-B1 | BENZOFURYL DERIVATIVES AND THEIR USE | HOFFMANN LA ROCHE (CH) | 2002-10-02 | — | — | EP | disclosed |
| US-5955495-A | BENZOFURAN-2-CARBOXAMIDINE OR 2-CARBOXAMIDOXIME COMPOUNDS USEFUL IN THE CONTROL OR PREVENTION OF ILLNESSES OR DISORDERS OF THE CENTRAL NERVOUS SYSTEM SUCH AS MIGRAINE, SCHIZOPHRENIA, ANXIETY STATES, SLEEP DISORDERS, ANOREXIA, ALZHEIMER'S | HOFFMANN-LA ROCHE INC. (US) | 1999-09-21 | — | — | US | disclosed |
| EP-0906301-A1 | BENZOFURYL DERIVATIVES AND THEIR USE | F. HOFFMANN-LA ROCHE AG (CH) | 1999-04-07 | — | — | EP | disclosed |
| WO-1997042183-A1 | BENZOFURYL DERIVATIVES AND THEIR USE | F. HOFFMANN-LA ROCHE AG (CH) | 1997-11-13 | — | — | WO | disclosed |