Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 6/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 5/20 | 0.38 |
| ▸ | CYP1A1 | P04798 | 5/20 | 0.35 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.30 |
| ▸ | MTNR1B | P49286 | 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 | |
|---|---|---|---|---|
| SCHEMBL4712951 | 0.81 | CYP1A2 (0.41) | CYP1A2CYP1B1CYP1A1CYP2B6MTNR1A | |
| SCHEMBL4502184 | 0.79 | CYP1A2 (0.39) | CYP1A2CYP1B1CYP1A1CYP2B6MTNR1A | |
| SCHEMBL4712134 | 0.66 | CYP1A2 (0.40) | CYP1A2CYP1B1CYP1A1CYP2B6MTNR1A | |
| SCHEMBL4496124 | 0.64 | CYP1A2 (0.41) | CYP1A2CYP1B1CYP1A1CYP2B6MTNR1A | |
| SCHEMBL30018362 | 0.59 | KMT2A (0.55) | — | |
| SCHEMBL8404603 | 0.58 | CYP1A2 (0.50) | CYP1A2CYP1B1CYP1A1CYP2B6MTNR1A | |
| SCHEMBL28041444 | 0.56 | TUBB4A (0.41) | — | |
| SCHEMBL29207958 | 0.56 | CYP1A2 (0.58) | CYP1A2CYP1B1CYP1A1CYP2B6MTNR1A | |
| SCHEMBL4762270 | 0.56 | CYP1A2 (0.41) | CYP1A2CYP1B1CYP1A1CYP2B6MTNR1A | |
| SCHEMBL16060891 | 0.56 | CYP1A2 (0.35) | CYP1A2CYP1B1CYP1A1CYP2B6MTNR1A |
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-1893617-A1 | TRICYCLIC COMPOUNDS USEFUL AS SEROTONIN INHIBITORS AND 5-HT1A AGONISTS AND ANTAGONISTS | Wyeth a Corporation of the State of Delaware (US) | 2008-03-05 | — | — | EP | disclosed |
| WO-2006138549-A1 | TRICYCLIC COMPOUNDS USEFUL AS SEROTONIN INHIBITORS AND 5-HT1A AGONISTS AND ANTAGONISTS | WYETH (US) | 2006-12-28 | — | — | WO | disclosed |