Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.38 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | SYK | P43405 | 1/20 | 0.38 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.36 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.36 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.36 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CTSL | P07711 | 1/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18634622 | 0.93 | AAK1 (0.43) | AAK1POLBITGB3ITGA2BCYP3A4 | |
| SCHEMBL15626653 | 0.90 | AAK1 (0.50) | AAK1POLBSYKLTA4HMAPT | |
| SCHEMBL15627206 | 0.88 | AAK1 (0.45) | AAK1POLBCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL15627205 | 0.88 | AAK1 (0.45) | AAK1POLBCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL15629455 | 0.87 | AAK1 (0.47) | AAK1POLBSYKLTA4HMAPT | |
| SCHEMBL12690327 | 0.86 | AAK1 (0.53) | AAK1POLBSYKLTA4HMAPT | |
| SCHEMBL16814420 | 0.84 | AAK1 (0.47) | AAK1POLBSYKLTA4HMAPT | |
| SCHEMBL16983171 | 0.83 | POLB (0.39) | POLBCYP3A4CYP2C9CYP2C19SYK | |
| SCHEMBL17263354 | 0.83 | POLB (0.39) | POLBCYP3A4CYP2C9CYP2C19SYK | |
| SCHEMBL18634820 | 0.83 | AAK1 (0.38) | AAK1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2897938-B1 | FLUOROALKYL DIBENZODIAZEPINONE COMPOUNDS | BRISTOL MYERS SQUIBB CO (US) | 2017-03-15 | — | — | EP | disclosed |