Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 2/20 | 0.31 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.30 |
| ▸ | BRD4 | O60885 | 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 | |
|---|---|---|---|---|
| SCHEMBL24095633 | 0.77 | CYP2D6 (0.31) | — | |
| SCHEMBL18833781 | 0.63 | TSHR (0.37) | PDE5ABRD4 | |
| SCHEMBL22111414 | 0.62 | PDE5A (0.33) | PDE5AP2RX3 | |
| SCHEMBL8007895 | 0.60 | PDE5A (0.39) | PDE5ABRD4 | |
| SCHEMBL18833638 | 0.60 | USP1 (0.38) | — | |
| SCHEMBL24095640 | 0.59 | ACHE (0.30) | — | |
| SCHEMBL18834562 | 0.57 | P2RX7 (0.40) | PDE5ABRD4 | |
| SCHEMBL20432551 | 0.56 | SMN1; SMN2 (0.35) | PDE5ABRD4 | |
| SCHEMBL4872435 | 0.55 | KMT2A (0.52) | — | |
| SCHEMBL22105360 | 0.53 | PDE5A (0.37) | PDE5A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3652176-B1 | SUBSTITUTED XANTHINE DERIVATIVES | BOEHRINGER INGELHEIM INT (DE) | 2021-12-15 | — | — | EP | disclosed |