Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 1/20 | 0.35 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.35 |
| ▸ | MTOR | P42345 | 1/20 | 0.31 |
| ▸ | NOS3 | P29474 | 1/20 | 0.31 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 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 | |
|---|---|---|---|---|
| SCHEMBL16414488 | 0.82 | CXCR4 (0.32) | — | |
| SCHEMBL29219470 | 0.80 | NOS3 (0.37) | PDE3BPDE3AMTORNOS3NOS1 | |
| SCHEMBL3266125 | 0.80 | PDE3B (0.39) | PDE3BPDE3AMTORNOS3NOS1 | |
| SCHEMBL24978543 | 0.76 | NOS2 (0.40) | PDE3BPDE3ANOS3NOS2 | |
| SCHEMBL6439643 | 0.73 | CXCR4 (0.41) | PDE3BPDE3A | |
| SCHEMBL3265508 | 0.73 | — | — | |
| SCHEMBL2029268 | 0.72 | CYP2A6 (0.34) | — | |
| SCHEMBL30465794 | 0.72 | CYP2A6 (0.34) | — | |
| SCHEMBL3635124 | 0.72 | CYP3A4 (0.30) | — | |
| SCHEMBL12770298 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9586978-B2 | Anti-viral compounds | ABBVIE INC. (US) | 2017-03-07 | — | — | US | disclosed |