Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | AXL | P30530 | 1/20 | 0.47 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.47 |
| ▸ | MERTK | Q12866 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | MTOR | P42345 | 1/20 | 0.47 |
| ▸ | CDK2 | P24941 | 3/20 | 0.47 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.47 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.46 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.46 |
| ▸ | CDK9 | P50750 | 1/20 | 0.46 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.46 |
| ▸ | IGF1R | P08069 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL1870819 | 0.89 | KDM4E (0.55) | CYP2C9CYP2C19LRRK2CYP1A2CYP3A4 | |
| SCHEMBL3504018 | 0.86 | CDK2 (0.48) | CYP2C9CYP2C19LRRK2CYP1A2CYP3A4 | |
| SCHEMBL1633172 | 0.84 | KDM4E (0.59) | ALDH1A1AXLTYRO3MERTKCDK2 | |
| SCHEMBL1632410 | 0.79 | MERTK (0.52) | ALDH1A1AXLTYRO3MERTKCDK2 | |
| SCHEMBL13251857 | 0.77 | CDK2 (0.49) | ALDH1A1AXLTYRO3MERTKCDK2 | |
| SCHEMBL1873404 | 0.76 | CDK1 (0.63) | LRRK2CDK2CCNE1CDK1CDK4 | |
| SCHEMBL1633526 | 0.75 | MAPK10 (0.63) | AXLTYRO3MERTKCDK2CCNE1 | |
| SCHEMBL1632893 | 0.75 | MERTK (0.49) | LRRK2ALDH1A1AXLTYRO3MERTK | |
| SCHEMBL1632404 | 0.75 | MAPK10 (0.63) | AXLTYRO3MERTKCDK2CCNE1 | |
| SCHEMBL1634204 | 0.75 | IKBKB (0.56) | AXLTYRO3MERTKCDK2CCNE1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008079988-A2 | QUINAZOLINES FOR PDK1 INHIBITION | NOVARTIS AG (CH) | 2008-07-03 | — | — | WO | disclosed |