Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR2 | O43614 | 7/20 | 0.41 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.35 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.35 |
| ▸ | SYK | P43405 | 10/20 | 0.33 |
| ▸ | CD63 | P08962 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL24529160 | 0.90 | HCRTR2 (0.49) | HCRTR2PDE3BPDE3ASYKCD63 | |
| SCHEMBL24386988 | 0.85 | ALDH1A1 (0.38) | HCRTR2PDE3BPDE3ASYKCD63 | |
| SCHEMBL24386929 | 0.82 | HCRTR2 (0.49) | HCRTR2PDE3BPDE3ASYKCD63 | |
| SCHEMBL24386927 | 0.79 | HCRTR2 (0.52) | HCRTR2PDE3BPDE3ASYKCD63 | |
| SCHEMBL24529251 | 0.76 | HCRTR2 (0.36) | HCRTR2PDE3BPDE3A | |
| SCHEMBL24386985 | 0.75 | EPHB4 (0.41) | HCRTR2SYKCD63 | |
| SCHEMBL24387005 | 0.74 | HCRTR2 (0.35) | HCRTR2PDE3BPDE3A | |
| SCHEMBL24386983 | 0.74 | HCRTR2 (0.48) | HCRTR2PDE3BPDE3ASYKCD63 | |
| SCHEMBL29750202 | 0.74 | HCRTR2 (0.48) | HCRTR2PDE3BPDE3ASYKCD63 | |
| SCHEMBL24529427 | 0.72 | HCRTR2 (0.33) | HCRTR2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022094012-A1 | MACROCYCLIC UREA OREXIN RECEPTOR AGONISTS | MERCK SHARP & DOHME CORP. (US) | 2022-05-05 | — | — | WO | disclosed |