Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 6/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 5/20 | 0.40 |
| ▸ | CYP1A1 | P04798 | 5/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.39 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.39 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.39 |
| ▸ | PIM1 | P11309 | 2/20 | 0.39 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.39 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.39 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.39 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.36 |
| ▸ | LTK | P29376 | 1/20 | 0.35 |
| ▸ | MST1R | Q04912 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | FABP6 | P51161 | 1/20 | 0.32 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4510020 | 0.75 | CYP1A2 (0.40) | CYP1A2CYP1B1CYP1A1CLK4DYRK1B | |
| SCHEMBL4712951 | 0.70 | CYP1A2 (0.41) | CYP1A2CYP1B1CYP1A1CYP2B6CA9 | |
| SCHEMBL4708357 | 0.69 | POLB (0.37) | DYRK1ACLK4CDK5PIM1ROCK1 | |
| SCHEMBL4510164 | 0.67 | CYP1A2 (0.39) | CYP1A2CYP1B1CYP1A1CYP2B6CA9 | |
| SCHEMBL4708855 | 0.67 | DYRK1A (0.40) | DYRK1ACLK4CDK5PIM1ROCK1 | |
| SCHEMBL4823014 | 0.66 | CYP1A2 (0.38) | CYP1A2CYP1B1CYP1A1CYP2B6MTNR1A | |
| SCHEMBL4762270 | 0.65 | CYP1A2 (0.41) | CYP1A2CYP1B1CYP1A1CYP2B6CA9 | |
| SCHEMBL4709030 | 0.64 | CDK5 (0.37) | DYRK1ACLK4CDK5PIM1ROCK1 | |
| SCHEMBL9626791 | 0.62 | CYP1A2 (0.46) | CYP1A2CYP1B1CYP1A1CYP2B6CA9 | |
| SCHEMBL29207958 | 0.61 | CYP1A2 (0.58) | CYP1A2CYP1B1CYP1A1CYP2B6CA9 |
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 |