Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 2/20 | 0.48 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | ACP3 | P15309 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.41 |
| ▸ | NQO2 | P16083 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5562773 | 0.74 | CYP2D6 (0.54) | SLC18A2SLC6A2SLC6A4MAPTCYP2D6 | |
| SCHEMBL5562778 | 0.74 | CYP2D6 (0.54) | SLC18A2SLC6A2SLC6A4MAPTCYP2D6 | |
| SCHEMBL3047898 | 0.71 | CYP1A2 (0.62) | DAOALDH1A1CYP2D6ACP3HSD17B10 | |
| SCHEMBL1314230 | 0.71 | DAO (0.50) | DAOSLC18A2SLC6A2SLC6A4ALDH1A1 | |
| SCHEMBL7050745 | 0.70 | SLC6A2 (0.63) | SLC18A2SLC6A2SLC6A4CYP2D6MTNR1A | |
| SCHEMBL7990233 | 0.70 | SLC6A4 (0.60) | SLC18A2SLC6A2SLC6A4CYP2D6 | |
| SCHEMBL8941742 | 0.70 | SLC18A2 (0.52) | DAOSLC18A2SLC6A2SLC6A4ALDH1A1 | |
| SCHEMBL5830749 | 0.69 | BCHE (0.61) | SLC18A2SLC6A2SLC6A4 | |
| SCHEMBL12405340 | 0.69 | SLC18A2 (0.51) | SLC18A2SLC6A2SLC6A4ALDH1A1MAPT | |
| SCHEMBL3096707 | 0.69 | SLC18A2 (0.45) | DAOSLC18A2SLC6A2SLC6A4ALDH1A1 |
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-2004089362-A1 | 2-CYANOPYRROLES AND THEIR ANALOGUES AS DDP-IV INHIBITORS | NOVO NORDISK A/S (DK) | 2004-10-21 | — | — | WO | disclosed |