Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.43 |
| ▸ | PGR | P06401 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | MGAM | O43451 | 1/20 | 0.43 |
| ▸ | SI | P14410 | 1/20 | 0.43 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | DGKA | P23743 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11878749 | 0.94 | CYP1A2 (0.52) | CYP1A2NR1I2PGRADORA3PTGS2 | |
| SCHEMBL3682278 | 0.88 | CYP1A2 (0.47) | CYP1A2NR1I2PGRADORA3PTGS2 | |
| SCHEMBL10180372 | 0.86 | CYP1A2 (0.44) | CYP1A2NR1I2PGRADORA3PTGS2 | |
| SCHEMBL29663869 | 0.86 | CYP1A2 (0.44) | CYP1A2NR1I2PGRADORA3PTGS2 | |
| Succinic Acid Diethyl Ester SCHEMBL17783729 | 0.85 | CYP1A2 (0.61) | CYP1A2NR1I2PGRADORA3PTGS2 | |
| SCHEMBL29165577 | 0.85 | DGKA (0.52) | CYP1A2ALDH1A1DGKA | |
| SCHEMBL27628460 | 0.84 | CYP1A2 (0.53) | CYP1A2NR1I2PGRADORA3PTGS2 | |
| SCHEMBL22817577 | 0.84 | TSHR (0.54) | CYP1A2GAAALDH1A1TSHRL3MBTL1 | |
| SCHEMBL453986 | 0.83 | LTA4H (0.44) | CYP1A2GAAMGAMSIMGAM2 | |
| SCHEMBL18334313 | 0.83 | CYP1A2 (0.41) | CYP1A2NR1I2PGRADORA3PTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| JP-8325276-A | — | — | None | — | — | JP | disclosed |
| US-6001739-A | Method of manufacturing a semiconductor device | TOKYO ELECTRON LIMITED (JP) | 1999-12-14 | — | — | US | disclosed |
| JP-H08325276-A | NEW ALKOXYSILANE COMPOUND AND ITS USE | MITSUBISHI MATERIALS CORP | 1996-12-10 | — | — | JP | disclosed |