Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.45 |
| ▸ | APP | P05067 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.43 |
| ▸ | TTR | P02766 | 1/20 | 0.43 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.42 |
| ▸ | EGFR | P00533 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 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 | |
|---|---|---|---|---|
| SCHEMBL14826756 | 0.82 | GABRA1 (0.57) | BACE1ALDH1A1PTPN1ALOX5GABRA1 | |
| SCHEMBL178369 | 0.81 | MAOB (0.52) | BACE1MAOBAPPALDH1A1TTR | |
| SCHEMBL30536248 | 0.80 | ALDH1A1 (0.52) | MAOBALDH1A1KDM4EMEN1USP2 | |
| SCHEMBL30229484 | 0.80 | HSD17B10 (0.57) | ALDH1A1HSD17B10 | |
| SCHEMBL2689127 | 0.80 | ALDH1A1 (0.52) | MAOBALDH1A1KDM4EMEN1USP2 | |
| SCHEMBL12476008 | 0.80 | ACHE (0.50) | ALDH1A1TDP1KDM4EMEN1USP2 | |
| SCHEMBL885029 | 0.80 | HSD17B10 (0.57) | ALDH1A1HSD17B10 | |
| SCHEMBL4619441 | 0.80 | MAPT (0.52) | CYP19A1ALDH1A1KDM4EMEN1USP2 | |
| SCHEMBL929750 | 0.79 | MEN1 (0.45) | ALDH1A1KDM4EMEN1MAPTTHRB | |
| SCHEMBL1821904 | 0.79 | KDM4E (0.51) | ALDH1A1HSD17B10TDP1KDM4EMEN1 |
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-2421855-A1 | DIARYL ETHERS | Tibotec Pharmaceuticals (IE) | 2012-02-29 | — | — | EP | disclosed |
| WO-2010122162-A1 | DIARYL ETHERS | TIBOTEC PHARMACEUTICALS (IE) | 2010-10-28 | — | — | WO | disclosed |