Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 15/20 | 0.61 |
| ▸ | HSD17B2 | P37059 | 15/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.61 |
| ▸ | CYP2B6 | P20813 | 4/20 | 0.61 |
| ▸ | ESR1 | P03372 | 3/20 | 0.51 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.51 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.46 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Water SCHEMBL6557294 | 0.98 | HSD17B1 (0.59) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL27542039 | 0.77 | HSD17B1 (0.60) | HSD17B1HSD17B2CYP3A4CYP2C19CYP2D6 | |
| SCHEMBL3358215 | 0.77 | ALOX5 (0.52) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL30944686 | 0.77 | ESR2 (0.81) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL29506882 | 0.77 | ESR2 (0.81) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL5302383 | 0.77 | ESR2 (0.81) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL30874112 | 0.77 | ALOX5 (0.66) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8084499 | 0.76 | HSD17B1 (0.40) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL3012675 | 0.76 | HSD17B1 (1.00) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL12023067 | 0.75 | CYP1A2 (0.52) | CYP1A2CYP2C9CYP2C19 |
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-1038877-B1 | Binaphthol monophosphoric acid derivative and its use | TOSOH CORP (JP) | 2004-03-10 | — | — | EP | disclosed |
| US-6274745-B1 | CATALYST | TOSOH CORPORATION (JP) | 2001-08-14 | — | — | US | disclosed |
| EP-1038877-A1 | Binaphthol monophosphoric acid derivative and its use | Tosoh Corporation (JP) | 2000-09-27 | — | — | EP | disclosed |