Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 1/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.33 |
| ▸ | AR | P10275 | 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 | |
|---|---|---|---|---|
| SCHEMBL8177691 | 0.83 | AR (0.35) | AR | |
| SCHEMBL5956014 | 0.79 | AR (0.34) | GABRA1GABRB2AR | |
| SCHEMBL14895318 | 0.77 | KIF11 (0.33) | AR | |
| SCHEMBL676948 | 0.77 | GABRA1 (0.40) | GABRA1GABRB2 | |
| SCHEMBL8138232 | 0.76 | AR (0.36) | AR | |
| SCHEMBL7452460 | 0.76 | GABRA1 (0.36) | GABRA1GABRB2 | |
| SCHEMBL27659611 | 0.76 | IDO1 (0.32) | — | |
| SCHEMBL27081615 | 0.75 | CYP3A4 (0.38) | — | |
| SCHEMBL8143824 | 0.74 | S1PR1 (0.33) | AR | |
| SCHEMBL8120187 | 0.73 | GABRA1 (0.38) | GABRA1GABRB2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011005295-A1 | MODULATORS OF THE SPHINGOSINE-1-PHOSPHATE (S1P) RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO | ARENA PHARMACEUTICALS, INC. (US) | 2011-01-13 | — | — | WO | claimed |
| WO-2011005295-A1 | MODULATORS OF THE SPHINGOSINE-1-PHOSPHATE (S1P) RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO | ARENA PHARMACEUTICALS, INC. (US) | 2011-01-13 | — | — | WO | disclosed |