Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 3/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 8/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 7/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 7/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 7/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.33 |
| ▸ | LTA4H | P09960 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10584058 | 0.83 | ACHE (0.37) | CYP2D6CYP19A1CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL6585059 | 0.81 | MGLL (0.43) | CYP2D6CYP19A1CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL5074489 | 0.81 | LTA4H (0.50) | CYP2D6CYP2C19CYP1A2CYP3A4LTA4H | |
| SCHEMBL8904260 | 0.81 | TDP1 (0.44) | CYP2C9CYP2C19CYP1A2CYP3A4KDM4E | |
| SCHEMBL8904259 | 0.81 | CYP2D6 (0.33) | CYP2D6CYP19A1CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL4872803 | 0.81 | CYP19A1 (0.34) | CYP2D6CYP19A1CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL6987433 | 0.81 | LTA4H (0.46) | CYP2D6CYP19A1CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL8712246 | 0.79 | THRB (0.33) | CYP2D6CYP19A1CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL3128008 | 0.78 | CYP3A4 (0.30) | CYP2D6CYP19A1CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL15867098 | 0.78 | NQO1 (0.36) | CYP2D6CYP19A1CYP2C9CYP2C19CYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3612520-A1 | AN ISOXAZOLE DERIVATIVES AS NUCLEAR RECEPTOR AGONISTS AND USED THEREOF | Il Dong Pharmaceutical Co., Ltd. (KR) | 2020-02-26 | — | — | EP | disclosed |
| WO-2018190643-A1 | AN ISOXAZOLE DERIVATIVES AS NUCLEAR RECEPTOR AGONISTS AND USED THEREOF | IL DONG PHARMACEUTICAL CO., LTD. (KR) | 2018-10-18 | — | — | WO | disclosed |