Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 2/20 | 0.54 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.44 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.44 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.44 |
| ▸ | SMG1 | Q96Q15 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | OGA | O60502 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | ELOVL1 | Q9BW60 | 1/20 | 0.42 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.42 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | ABL1 | P00519 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | CDK1 | P06493 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 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 | |
|---|---|---|---|---|
| SCHEMBL3742630 | 0.84 | PIK3CA (0.57) | PIK3CALRRK2PIK3CBABL1KMO | |
| SCHEMBL5718308 | 0.84 | PIK3CA (0.54) | PIK3CALRRK2OPRM1OPRL1PIK3CB | |
| SCHEMBL2459118 | 0.84 | PIK3CA (0.54) | PIK3CALRRK2OPRM1OPRL1PIK3CB | |
| SCHEMBL8197483 | 0.84 | PIK3CA (0.59) | PIK3CALRRK2OPRM1OPRL1PIK3CB | |
| SCHEMBL15504891 | 0.83 | HRH4 (0.50) | OPRM1OPRL1CYP1A2SMN1; SMN2ELOVL1 | |
| SCHEMBL10210050 | 0.83 | PIK3CA (0.50) | PIK3CALRRK2PIK3CBSMG1MAPT | |
| SCHEMBL13069962 | 0.81 | PIK3CA (0.53) | PIK3CALRRK2OPRM1OPRL1PIK3CB | |
| SCHEMBL8228263 | 0.80 | LRRK2 (0.56) | PIK3CALRRK2OPRM1OPRL1PIK3CB | |
| SCHEMBL10154083 | 0.80 | PIK3CA (0.50) | PIK3CALRRK2OPRM1OPRL1PIK3CB | |
| SCHEMBL13028832 | 0.80 | PIK3CA (0.50) | PIK3CALRRK2OPRM1OPRL1PIK3CB |
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-7598242-B2 | Compounds for the treatment of inflammatory disorders | SCHERING CORPORATION (US) | 2009-10-06 | — | — | US | disclosed |
| US-7598242-B2 | Compounds for the treatment of inflammatory disorders | SCHERING CORPORATION (US) | 2009-10-06 | — | — | US | disclosed |
| WO-2003053915-A2 | COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS | SCHERING CORPORATION (US) | 2003-07-03 | — | — | WO | disclosed |