Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 2/20 | 0.48 |
| ▸ | PIM2 | Q9P1W9 | 2/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.43 |
| ▸ | FEN1 | P39748 | 2/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.43 |
| ▸ | METAP2 | P50579 | 1/20 | 0.42 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.42 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.42 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.42 |
| ▸ | PI4KA | P42356 | 1/20 | 0.42 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.42 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.42 |
| ▸ | EDNRB | P24530 | 1/20 | 0.41 |
| ▸ | EDNRA | P25101 | 1/20 | 0.41 |
| ▸ | TOP1 | P11387 | 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 | |
|---|---|---|---|---|
| SCHEMBL9974997 | 0.98 | PIM1 (0.47) | PIM1PIM2CYP19A1CYP2D6CYP2C9 | |
| SCHEMBL9974998 | 0.92 | PIM2 (0.45) | PIM1PIM2CYP19A1CYP2D6CYP2C9 | |
| SCHEMBL30128471 | 0.89 | ALOX5AP (0.48) | PIM1PIM2CYP19A1CYP2D6CYP2C9 | |
| SCHEMBL9974932 | 0.89 | CYP2A6 (0.53) | CYP19A1CYP2D6CYP2C9CYP2C19ALOX5AP | |
| SCHEMBL9974994 | 0.89 | CYP2A6 (0.49) | PIM2CYP19A1CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL13457927 | 0.88 | CYP19A1 (0.51) | PIM1PIM2CYP19A1CYP2D6CYP2C9 | |
| SCHEMBL166615 | 0.88 | CYP2A6 (0.52) | PIM1PIM2CYP19A1CYP2D6CYP2C9 | |
| SCHEMBL29904375 | 0.88 | CYP2A6 (0.52) | PIM1PIM2CYP19A1CYP2D6CYP2C9 | |
| SCHEMBL9975001 | 0.88 | CYP2A6 (0.47) | PIM1CYP19A1CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL9974960 | 0.88 | CYP2A6 (0.50) | CYP19A1CYP2D6CYP2C9CYP2C19CYP2A6 |
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-2012081541-A1 | 1, 2, 4, 5-SUBSTITUTED PHENYL DERIVATIVE, PRODUCTION METHOD FOR SAME, AND ORGANIC ELECTROLUMINESCENT ELEMENT | 東ソー株式会社 (JP) | 2012-06-21 | — | — | WO | disclosed |