Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 4/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.32 |
| ▸ | NCF1 | P14598 | 1/20 | 0.32 |
| ▸ | PLD1 | Q13393 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7397976 | 0.88 | CYP2D6 (0.36) | CYP2D6SLC6A2SLC6A4SLC6A3HTR2C | |
| SCHEMBL7401763 | 0.86 | MAPK13 (0.37) | CYP2D6SLC6A2SLC6A4SLC6A3HTR2C | |
| SCHEMBL7359408 | 0.83 | CYP2D6 (0.45) | CYP2D6SLC6A2SLC6A4SLC6A3HTR2C | |
| SCHEMBL7358923 | 0.80 | CYP2D6 (0.41) | CYP2D6SLC6A2SLC6A4SLC6A3HTR2C | |
| Hydrochloric Acid SCHEMBL7365020 | 0.79 | CYP2D6 (0.41) | CYP2D6SLC6A2SLC6A4SLC6A3HTR2C | |
| SCHEMBL7397935 | 0.77 | KDM4E (0.34) | CYP2D6SLC6A2SLC6A4SLC6A3L3MBTL1 | |
| SCHEMBL28112889 | 0.76 | ADRB2 (0.49) | CYP2D6SLC6A2SLC6A4SLC6A3HTR2C | |
| SCHEMBL7359288 | 0.76 | SLC6A2 (0.45) | CYP2D6SLC6A2SLC6A4SLC6A3HTR2C | |
| SCHEMBL7401089 | 0.75 | GAA (0.48) | CYP2D6SLC6A2SLC6A4SLC6A3GAA | |
| SCHEMBL7400665 | 0.74 | CYP2D6 (0.38) | CYP2D6SLC6A2SLC6A4SLC6A3HTR2C |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5563141-A | INHIBIT CELL ADHESION FOR EXAMPLE, PLATELET AGGRE GATION | ZENECA LIMITED (GB) | 1996-10-08 | — | — | US | disclosed |
| EP-0690847-A1 | HETEROCYCLIC COMPOUNDS AS PLATELET AGGREGATION INHIBITORS | ZENECA LIMITED (GB) | 1996-01-10 | — | — | EP | disclosed |
| WO-1994022835-A2 | HETEROCYCLIC COMPOUNDS AS PLATELET AGGREGATION INHIBITORS | ZENECA LIMITED (GB) | 1994-10-13 | — | — | WO | disclosed |