Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 9/20 | 0.40 |
| ▸ | HSD17B2 | P37059 | 9/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.40 |
| ▸ | CYP2B6 | P20813 | 3/20 | 0.40 |
| ▸ | ABL1 | P00519 | 2/20 | 0.38 |
| ▸ | GRIA1 | P42261 | 3/20 | 0.38 |
| ▸ | CACNG8 | Q8WXS5 | 3/20 | 0.38 |
| ▸ | SRC | P12931 | 1/20 | 0.36 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6557612 | 0.76 | HSD17B1 (0.61) | HSD17B1HSD17B2CYP1A2CYP2D6CYP3A4 | |
| Water SCHEMBL6557294 | 0.75 | HSD17B1 (0.59) | HSD17B1HSD17B2CYP1A2CYP2D6CYP3A4 | |
| Phosphoric Acid SCHEMBL6558539 | 0.74 | HSD17B1 (0.36) | HSD17B1HSD17B2CYP1A2CYP2D6CYP3A4 | |
| SCHEMBL3894465 | 0.72 | PTPN5 (0.45) | CYP1A2CYP2D6FFAR1 | |
| SCHEMBL3885852 | 0.71 | PTK2B (0.43) | HSD17B1HSD17B2CYP1A2CYP2D6GRIA1 | |
| SCHEMBL297439 | 0.70 | GPR84 (0.69) | HSD17B1HSD17B2CYP1A2CYP2D6CYP3A4 | |
| SCHEMBL28080572 | 0.70 | WDR5 (0.47) | — | |
| SCHEMBL1133131 | 0.68 | IKBKB (0.54) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL6557297 | 0.68 | GPR84 (0.51) | HSD17B1HSD17B2CYP1A2CYP2D6CYP3A4 | |
| SCHEMBL6556996 | 0.67 | GPR84 (0.50) | HSD17B1HSD17B2CYP1A2CYP2D6CYP3A4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1038877-A1 | Binaphthol monophosphoric acid derivative and its use | Tosoh Corporation (JP) | 2000-09-27 | — | — | EP | disclosed |