Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.49 |
| ▸ | BACE1 | P56817 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | PDE4A | P27815 | 1/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.43 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.43 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | PI4KB | Q9UBF8 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13564870 | 1.00 | ACHE (0.49) | ACHEBACE1L3MBTL1PDE4APDE4B | |
| SCHEMBL13564856 | 0.90 | ACHE (0.42) | ACHEBACE1L3MBTL1PI4KBMAPT | |
| SCHEMBL13564855 | 0.90 | KMT2A (0.46) | ACHEBACE1L3MBTL1PI4KBHPGD | |
| SCHEMBL17090105 | 0.90 | KMT2A (0.46) | ACHEBACE1L3MBTL1PI4KBHPGD | |
| SCHEMBL17090107 | 0.90 | ACHE (0.42) | ACHEBACE1L3MBTL1PI4KBMAPT | |
| SCHEMBL13564860 | 0.88 | ACHE (0.43) | ACHEBACE1L3MBTL1PDE4APDE4B | |
| SCHEMBL17090068 | 0.88 | ACHE (0.43) | ACHEBACE1L3MBTL1PDE4APDE4B | |
| SCHEMBL17090335 | 0.87 | TDP1 (0.42) | ACHEBACE1L3MBTL1PI4KBALDH1A1 | |
| SCHEMBL11934885 | 0.87 | TDP1 (0.42) | ACHEBACE1L3MBTL1PI4KBALDH1A1 | |
| SCHEMBL13565544 | 0.86 | TSHR (0.42) | ACHEBACE1PI4KBHPGDMAPT |
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-9139518-B2 | Amine derivative having NPY Y5 receptor antagonistic activity | SHIONOGI & CO., LTD. (JP) | 2015-09-22 | — | — | US | disclosed |