Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.35 |
| ▸ | METAP1 | P53582 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6504169 | 1.00 | NPSR1 (0.42) | NPSR1ALOX15HCAR2METAP1ALDH1A1 | |
| SCHEMBL4446761 | 1.00 | NPSR1 (0.42) | NPSR1ALOX15HCAR2METAP1ALDH1A1 | |
| SCHEMBL4446758 | 1.00 | NPSR1 (0.42) | NPSR1ALOX15HCAR2METAP1ALDH1A1 | |
| SCHEMBL4446753 | 1.00 | NPSR1 (0.42) | NPSR1ALOX15HCAR2METAP1ALDH1A1 | |
| SCHEMBL6504174 | 1.00 | NPSR1 (0.42) | NPSR1ALOX15HCAR2METAP1ALDH1A1 | |
| SCHEMBL4454382 | 0.86 | NPSR1 (0.44) | NPSR1ALOX15HCAR2ALDH1A1MAPT | |
| SCHEMBL6399583 | 0.86 | NPSR1 (0.44) | NPSR1ALOX15HCAR2ALDH1A1MAPT | |
| SCHEMBL6399581 | 0.86 | NPSR1 (0.44) | NPSR1ALOX15HCAR2ALDH1A1MAPT | |
| SCHEMBL4447209 | 0.78 | NPSR1 (0.38) | NPSR1HCAR2METAP1ALDH1A1MAPT | |
| SCHEMBL4447215 | 0.78 | NPSR1 (0.38) | NPSR1HCAR2METAP1ALDH1A1MAPT |
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-2005102390-A2 | COMBINATIONS COMPRISING ALPHA-2-DELTA LIGANDS AND NMDA RECEPTOR ANTAGONISTS | PFIZER JAPAN, INC. (JP) | 2005-11-03 | — | — | WO | disclosed |