Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 2/20 | 0.61 |
| ▸ | HTT | P42858 | 3/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | CA12 | O43570 | 1/20 | 0.53 |
| ▸ | CA1 | P00915 | 1/20 | 0.53 |
| ▸ | CA2 | P00918 | 1/20 | 0.53 |
| ▸ | CA4 | P22748 | 1/20 | 0.53 |
| ▸ | CA9 | Q16790 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.51 |
| ▸ | GLA | P06280 | 1/20 | 0.51 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL5069115 | 0.85 | BCHE (0.76) | BCHEHTTCYP2D6CYP2C19CYP3A4 | |
| SCHEMBL1719403 | 0.79 | BCHE (0.67) | BCHEHTTCYP2D6CYP2C19CYP3A4 | |
| SCHEMBL30213077 | 0.79 | BCHE (0.67) | BCHEHTTCYP2D6CYP2C19CYP3A4 | |
| SCHEMBL7716811 | 0.78 | L3MBTL1 (0.44) | BCHECYP2D6CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL9404939 | 0.76 | ADRB2 (0.49) | CYP2D6CYP2C19CYP3A4CA12CA1 | |
| SCHEMBL19532590 | 0.76 | BCHE (0.71) | BCHEHTTCYP2D6CYP2C19CYP3A4 | |
| SCHEMBL19532591 | 0.76 | BCHE (1.00) | BCHEHTTCYP2D6CYP2C19CYP3A4 | |
| Acetic Acid SCHEMBL28722943 | 0.75 | HTT (0.76) | BCHEHTTCYP2D6CYP2C19CYP3A4 | |
| SCHEMBL9404905 | 0.75 | ADRB2 (0.48) | CYP3A4CA12CA1CA2CA9 | |
| SCHEMBL19532621 | 0.74 | BCHE (1.00) | BCHEHTTCYP2D6CYP2C19CYP3A4 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6407229-B1 | ENZYME INHIBITOR | SANOCHEMIA PHARMAZEUTIKA AG (AT) | 2002-06-18 | — | — | US | disclosed |
| US-6369238-B1 | ENZYME INHIBITORS USED IN THE TREATMENT OF ALZHEIMER'S DISEASE | SANOCHEMIA PHARMAZEUTICA (AT) | 2002-04-09 | — | — | US | disclosed |
| US-6043359-A | REACTING A BENZALDEHYDE DERIVATIVE WITH A BENZENE ETHYLAMINE DERIVATIVE TO FORM A SCHIFF BASE, REDUCING THE SCHIFF BASE TO PRODUCE AN INTERMEDIATE, OXIDATIVELY CYCLYZATION, THEN STEREOSELECTIVE REDUCTION FORMS END PRODUCT | SANOCHEMIA PHARMAZEUTICA AKTIENGESELLSCHAFT (AT) | 2000-03-28 | — | — | US | disclosed |
| EP-0787115-B1 | PROCESS FOR PRODUCING DERIVATIVES OF 4a,5,9,10,11,12,-HEXAHYDRO-6H-BENZOFURO[3a,3,2-ef][2]BENZAZEPINE | SANOCHEMIA PHARMAZEUTIKA AG (AT) | 2000-01-05 | — | — | EP | disclosed |
| EP-0787115-A1 | PROCESS FOR PRODUCING DERIVATIVES OF 4a,5,9,10,11,12,-HEXAHYDRO-6H-BENZOFURO 3a,3,2-ef] 2]BENZAZEPINE | Waldheim Pharmazeutika Gesellschaft m.b.H. (AT) | 1997-08-06 | — | — | EP | disclosed |
| WO-1996012692-A1 | PROCESS FOR PRODUCING DERIVATIVES OF 4a,5,9,10,11,12,-HEXAHYDRO-6H-BENZOFURO[3a,3,2-ef][2]BENZAZEPINE | WALDHEIM PHARMAZEUTIKA GESELLSCHAFT M.B.H. (AT) | 1996-05-02 | — | — | WO | disclosed |