Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCDIN3D | Q7Z5W3 | 2/20 | 0.42 |
| ▸ | PDE5A | O76074 | 13/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | GALR3 | O60755 | 1/20 | 0.38 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5117610 | 0.97 | PDE5A (0.42) | BCDIN3DPDE5ANPC1GALR3NR2F2 | |
| SCHEMBL7508291 | 0.92 | BCDIN3D (0.42) | BCDIN3DPDE5A | |
| SCHEMBL5128040 | 0.89 | PDE5A (0.43) | BCDIN3DPDE5A | |
| SCHEMBL5122834 | 0.89 | NPC1 (0.48) | PDE5ANPC1GALR3NR2F2RAB9A | |
| SCHEMBL5114999 | 0.87 | PRKCI (0.43) | BCDIN3DPDE5A | |
| SCHEMBL5128521 | 0.87 | ADORA2A (0.49) | — | |
| SCHEMBL7512073 | 0.87 | MAPT (0.47) | BCDIN3DPDE5A | |
| SCHEMBL5113662 | 0.85 | PDE5A (0.47) | PDE5ANPC1 | |
| SCHEMBL5115283 | 0.85 | PDE5A (0.45) | BCDIN3DPDE5A | |
| SCHEMBL7504877 | 0.84 | MAPT (0.41) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0920431-A1 | THIENOPYRIMIDINES | MERCK PATENT GmbH (DE) | 1999-06-09 | — | — | EP | disclosed |
| WO-1998006722-A1 | THIENOPYRIMIDINES | MERCK PATENT GMBH (DE) | 1998-02-19 | — | — | WO | disclosed |