Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 3/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.35 |
| ▸ | PDE4A | P27815 | 1/20 | 0.35 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
| ▸ | QDPR | P09417 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL27450323 | 0.76 | CHRM2 (0.36) | SLC6A2SLC6A4SLC6A3QDPRDRD2 | |
| SCHEMBL6556202 | 0.76 | SLC6A2 (0.36) | SLC6A2SLC6A4SLC6A3PDE4BPDE4A | |
| SCHEMBL6556205 | 0.76 | SLC6A2 (0.36) | SLC6A2SLC6A4SLC6A3PDE4BPDE4A | |
| SCHEMBL6558346 | 0.76 | SLC6A2 (0.36) | SLC6A2SLC6A4SLC6A3PDE4BPDE4A | |
| SCHEMBL6558339 | 0.76 | SLC6A2 (0.36) | SLC6A2SLC6A4SLC6A3PDE4BPDE4A | |
| SCHEMBL6556208 | 0.76 | SLC6A2 (0.36) | SLC6A2SLC6A4SLC6A3PDE4BPDE4A | |
| SCHEMBL27492833 | 0.76 | ESR1 (0.35) | PDE4BQDPRHTR4 | |
| SCHEMBL27424957 | 0.76 | ESR1 (0.35) | PDE4BQDPRHTR4 | |
| SCHEMBL6557719 | 0.73 | ALDH1A1 (0.35) | PDE4BPDE4APDE4CPDE4DSMN1; SMN2 | |
| SCHEMBL6558324 | 0.68 | ALDH1A1 (0.35) | PDE4BPDE4APDE4CPDE4DSMN1; SMN2 |
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-0958285-B1 | TRICYCLIC BENZO[e]ISOINDOLES AND BENZO[h]ISOQUINOLINES | HOFFMANN LA ROCHE (CH) | 2004-01-07 | — | — | EP | disclosed |
| US-6310208-B1 | Serotonin receptor binding benzo[e]isoindoles and benzo[h]isoquinolines | HOFFMANN-LA ROCHE INC. | 2001-10-30 | — | — | US | disclosed |
| EP-0958285-A1 | TRICYCLIC BENZO[e]ISOINDOLES AND BENZO[h]ISOQUINOLINES | F.HOFFMANN-LA ROCHE AG (CH) | 1999-11-24 | — | — | EP | disclosed |
| WO-1998030546-A1 | TRICYCLIC BENZO[e]ISOINDOLES AND BENZO[h]ISOQUINOLINES | F. HOFFMANN-LA ROCHE AG (CH) | 1998-07-16 | — | — | WO | disclosed |