Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 12/20 | 0.65 |
| ▸ | IMPDH2 | P12268 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | ANPEP | P15144 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL25315485 | 1.00 | SMYD3 (0.65) | SMYD3IMPDH2ALDH1A1NPC1LMNA | |
| SCHEMBL30376200 | 1.00 | SMYD3 (0.65) | SMYD3IMPDH2ALDH1A1NPC1LMNA | |
| SCHEMBL18006588 | 1.00 | SMYD3 (0.65) | SMYD3IMPDH2ALDH1A1NPC1LMNA | |
| SCHEMBL18006574 | 0.90 | SMYD3 (0.53) | SMYD3IMPDH2ALDH1A1NPC1LMNA | |
| SCHEMBL25312585 | 0.89 | SMYD3 (0.55) | SMYD3ANPEP | |
| SCHEMBL25312590 | 0.89 | SMYD3 (0.55) | SMYD3ANPEP | |
| SCHEMBL30376271 | 0.89 | SMYD3 (0.55) | SMYD3ANPEP | |
| SCHEMBL25311225 | 0.88 | SMYD3 (0.52) | SMYD3ANPEP | |
| SCHEMBL25313541 | 0.88 | AKT1 (0.56) | SMYD3ANPEP | |
| SCHEMBL25311973 | 0.88 | SMYD3 (0.62) | SMYD3ALDH1A1ANPEP |
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-4157858-A2 | SMALL MOLECULE INHIBITORS OF GRK5 AND GRK5 SUBFAMILY MEMBERS AND USES THEREOF | The Regents of The University of Michigan (US) | 2023-04-05 | — | — | EP | disclosed |