Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 10/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 9/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 9/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 9/20 | 0.42 |
| ▸ | CLK4 | Q9HAZ1 | 6/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 8/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.40 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.39 |
| ▸ | FEN1 | P39748 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 2/20 | 0.37 |
| ▸ | LATS1 | O95835 | 1/20 | 0.37 |
| ▸ | LATS2 | Q9NRM7 | 1/20 | 0.37 |
| ▸ | TRIM58 | Q8NG06 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL14727487 | 0.91 | CYP1A2 (0.41) | CYP1A2CYP3A4CYP2D6CYP2C19CLK4 | |
| SCHEMBL16183643 | 0.86 | CYP1A2 (0.58) | CYP1A2CYP3A4CYP2D6CYP2C19CLK4 | |
| SCHEMBL14475187 | 0.84 | FEN1 (0.43) | CYP1A2CYP3A4CYP2D6CYP2C19CLK4 | |
| SCHEMBL16183729 | 0.83 | CYP1A2 (0.41) | CYP1A2CYP3A4CYP2D6CYP2C19CLK4 | |
| SCHEMBL16183726 | 0.82 | CYP1A2 (0.45) | CYP1A2CYP3A4CYP2D6CYP2C19CLK4 | |
| SCHEMBL18022961 | 0.82 | CYP1A2 (0.41) | CYP1A2CYP3A4CYP2D6CYP2C19CLK4 | |
| SCHEMBL16184212 | 0.81 | CYP1A2 (0.39) | CYP1A2CYP3A4CYP2D6CYP2C19CLK4 | |
| SCHEMBL16184366 | 0.78 | ALOX5AP (0.38) | CYP1A2CYP3A4CYP2D6CYP2C19CLK4 | |
| SCHEMBL16183641 | 0.78 | CYP1A2 (0.58) | CYP1A2CYP3A4CYP2D6CYP2C19CLK4 | |
| SCHEMBL2154624 | 0.78 | CYP1A2 (0.60) | CYP1A2CYP3A4CYP2D6CYP2C19CLK4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3056207-B1 | THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE | OTSUKA PHARMA CO LTD (JP) | 2018-06-20 | — | — | EP | disclosed |
| EP-3056207-A1 | THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE | Otsuka Pharmaceutical Co., Ltd. (JP) | 2016-08-17 | — | — | EP | disclosed |
| WO-2013003586-A1 | QUINAZOLINES AS THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2013-01-03 | — | — | WO | disclosed |