Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.41 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.40 |
| ▸ | TERT | O14746 | 2/20 | 0.40 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.40 |
| ▸ | OGA | O60502 | 1/20 | 0.39 |
| ▸ | SYK | P43405 | 1/20 | 0.38 |
| ▸ | SLC8A1 | P32418 | 1/20 | 0.38 |
| ▸ | KLKB1 | P03952 | 2/20 | 0.38 |
| ▸ | KLK1 | P06870 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7677919 | 0.83 | CYP2C19 (0.67) | CYP3A4CYP2D6CYP2C19SLC40A1GAA | |
| SCHEMBL7682114 | 0.81 | CYP2C19 (0.60) | CYP3A4CYP2D6CYP2C19SLC40A1PIK3CA | |
| SCHEMBL7681152 | 0.81 | CYP2D6 (0.55) | CYP3A4CYP2D6CYP2C19SLC40A1KDM4E | |
| SCHEMBL10154083 | 0.79 | PIK3CA (0.50) | CYP3A4CYP2C19KDM4EPIK3CAOPRM1 | |
| SCHEMBL7679598 | 0.76 | CYP3A4 (0.58) | CYP3A4CYP2D6CYP2C19SLC40A1KDM4E | |
| SCHEMBL10210050 | 0.76 | PIK3CA (0.50) | KDM4EPIK3CACDK2PIK3CBOGA | |
| SCHEMBL24455071 | 0.75 | RAB9A (0.53) | CYP2C19KDM4EGAAPIK3CAPIK3CB | |
| SCHEMBL29561895 | 0.75 | RAB9A (0.53) | CYP2C19KDM4EGAAPIK3CAPIK3CB | |
| SCHEMBL8197483 | 0.74 | PIK3CA (0.59) | CYP2C19PIK3CAOPRM1OPRL1PIK3CB | |
| SCHEMBL8228263 | 0.73 | LRRK2 (0.56) | CYP2C19PIK3CAOPRM1OPRL1PIK3CB |
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-6455520-B1 | TUMOR NECROSIS FACTOR AND INTERLEUKIN INHIBITORS; ANTIINFLAMMATORY AGENTS, ANTIALLERGENS; BONE DISORDERS | ASTRA ZENECA AB (SE) | 2002-09-24 | — | — | US | disclosed |