Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HIF1A | Q16665 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.32 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.32 |
| ▸ | ROCK1 | Q13464 | 4/20 | 0.32 |
| ▸ | ITGB3 | P05106 | 5/20 | 0.31 |
| ▸ | ITGA2B | P08514 | 5/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.31 |
| ▸ | PKN2 | Q16513 | 3/20 | 0.31 |
| ▸ | RPS6KA5 | O75582 | 2/20 | 0.31 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.31 |
| ▸ | TP53 | P04637 | 2/20 | 0.31 |
| ▸ | CHUK | O15111 | 1/20 | 0.31 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.31 |
| ▸ | CDK1 | P06493 | 1/20 | 0.31 |
| ▸ | CDK2 | P24941 | 1/20 | 0.31 |
| ▸ | LTK | P29376 | 1/20 | 0.31 |
| ▸ | CDK8 | P49336 | 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 | |
|---|---|---|---|---|
| SCHEMBL8613950 | 0.74 | KDM4E (0.39) | CYP2D6CYP2C9GRIN2BALDH1A1 | |
| SCHEMBL8300039 | 0.73 | ITGB3 (0.40) | TDP1ITGB3ITGA2BCYP2D6CYP2C9 | |
| SCHEMBL8617676 | 0.72 | HRH3 (0.46) | EPHX2KCNH2 | |
| SCHEMBL8302338 | 0.69 | ITGB3 (0.42) | TDP1ITGB3ITGA2BCYP2D6HTT | |
| SCHEMBL1837106 | 0.60 | CHKA (0.46) | TDP1CYP3A4CYP1A2CYP2C19 | |
| SCHEMBL5255784 | 0.60 | CTSD (0.39) | TDP1ROCK1ALDH1A1 | |
| SCHEMBL6353532 | 0.59 | CHKA (0.45) | TDP1ROCK1CYP3A4CYP1A2CYP2C19 | |
| SCHEMBL8300331 | 0.59 | KDM4E (0.43) | ITGB3ITGA2BCYP2D6CYP2C9GRIN2B | |
| SCHEMBL8300260 | 0.58 | ITGB3 (0.38) | ITGB3ITGA2BCYP3A4CYP1A2CYP2D6 | |
| SCHEMBL7735744 | 0.56 | L3MBTL1 (0.49) | ALDH1A1CYP2C19 |
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-5786371-A | INHIBIT AGGREGATION OF BLOOD PLATELETS | BOEHRINGER MANNHEIM GMBH (DE) | 1998-07-28 | — | — | US | disclosed |