Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | HTR1D | P28221 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | STS | P08842 | 10/20 | 0.41 |
| ▸ | ABCC4 | O15439 | 3/20 | 0.40 |
| ▸ | ABCC1 | P33527 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CA6 | P23280 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5686345 | 1.00 | DRD2 (0.46) | DRD2HTR1DDRD3AKR1C3STS | |
| SCHEMBL5683918 | 0.79 | STS (0.50) | STSCYP2C9ESR1ESR2 | |
| SCHEMBL5683915 | 0.79 | STS (0.50) | STSCYP2C9ESR1ESR2 | |
| SCHEMBL5686598 | 0.78 | DRD2 (0.47) | DRD2HTR1DDRD3AKR1C3 | |
| SCHEMBL5686604 | 0.78 | DRD2 (0.47) | DRD2HTR1DDRD3AKR1C3 | |
| SCHEMBL7530599 | 0.74 | STS (0.43) | DRD2STS | |
| SCHEMBL27051298 | 0.71 | STS (0.54) | AKR1C3STSABCC4ABCC1 | |
| SCHEMBL12054334 | 0.71 | STS (0.77) | STSABCC4ABCC1KDM4ECA1 | |
| SCHEMBL31321077 | 0.71 | STS (0.77) | STSABCC4ABCC1KDM4ECA1 | |
| SCHEMBL3825597 | 0.71 | STS (0.77) | STSABCC4ABCC1KDM4ECA1 |
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-7067179-B1 | Fused ring compound | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2006-06-27 | — | — | US | disclosed |
| EP-1201632-B1 | FUSED RING COMPOUND | DAINIPPON INK & CHEMICALS (JP) | 2006-03-29 | — | — | EP | disclosed |
| EP-1201632-A1 | FUSED RING COMPOUND | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2002-05-02 | — | — | EP | disclosed |