Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 1/20 | 0.42 |
| ▸ | SYK | P43405 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | GCK | P35557 | 3/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ACE | P12821 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | APP | P05067 | 1/20 | 0.35 |
| ▸ | CTSS | P25774 | 2/20 | 0.35 |
| ▸ | CTSL | P07711 | 1/20 | 0.35 |
| ▸ | CTSB | P07858 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.35 |
| ▸ | SCD | O00767 | 1/20 | 0.35 |
| ▸ | RARA | P10276 | 1/20 | 0.35 |
| ▸ | RARB | P10826 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6058970 | 0.91 | GRIN2B (0.38) | GRIN2BSYKHDAC1MAPK1MAPT | |
| SCHEMBL6058813 | 0.89 | GRIN2B (0.42) | GRIN2BSYKHDAC1ATMACE | |
| SCHEMBL6058760 | 0.86 | GRIN2B (0.40) | GRIN2BSYKHDAC1MAPK1CTSS | |
| SCHEMBL6058769 | 0.86 | GRIN2B (0.38) | GRIN2BSYKHDAC1MAPK1MAPT | |
| SCHEMBL6059207 | 0.85 | GRIN2B (0.43) | GRIN2BSYKHDAC1ATMACE | |
| SCHEMBL6058921 | 0.84 | GRIN2B (0.37) | GRIN2BHDAC1MAPK1MAPT | |
| SCHEMBL6058894 | 0.80 | CYP17A1 (0.39) | GRIN2BSYKHDAC1MAPK1ALDH1A1 | |
| SCHEMBL6058758 | 0.79 | NAMPT (0.41) | GRIN2BSYKHDAC1MAPK1SCD | |
| SCHEMBL6059691 | 0.77 | GRIN2B (0.39) | GRIN2BMAPK1ALDH1A1MAPT | |
| SCHEMBL6059388 | 0.76 | GRIN2B (0.39) | GRIN2BHDAC1ATMCTSSCTSL |
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-7071175-B1 | Pyridine mercapto carboxylic acids as carboxypeptidase U inhibitors | ASTRAZENECA AB (SE) | 2006-07-04 | — | — | US | disclosed |