Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.63 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.63 |
| ▸ | INPP5D | Q92835 | 1/20 | 0.62 |
| ▸ | CDC25A | P30304 | 3/20 | 0.60 |
| ▸ | POLA1 | P09884 | 1/20 | 0.60 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.58 |
| ▸ | USP2 | O75604 | 2/20 | 0.56 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.54 |
| ▸ | CASP7 | P55210 | 3/20 | 0.54 |
| ▸ | GPBAR1 | Q8TDU6 | 3/20 | 0.54 |
| ▸ | EPHA2 | P29317 | 3/20 | 0.54 |
| ▸ | TP53 | P04637 | 2/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.54 |
| ▸ | BLM | P54132 | 2/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.54 |
| ▸ | VDR | P11473 | 2/20 | 0.54 |
| ▸ | MDM4 | O15151 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL7997759 | 1.00 | CYP2C19 (0.63) | CYP2C19CYP2D6INPP5DCDC25APOLA1 | |
| SCHEMBL17817066 | 0.93 | CYP2C19 (0.66) | CYP2C19CYP2D6INPP5DCDC25APOLA1 | |
| Hydrochloric Acid SCHEMBL8003235 | 0.92 | INPP5D (0.66) | CYP2C19CYP2D6INPP5DCDC25APOLA1 | |
| Hydrochloric Acid SCHEMBL8003237 | 0.92 | INPP5D (0.66) | CYP2C19CYP2D6INPP5DCDC25APOLA1 | |
| SCHEMBL17817283 | 0.91 | CDC25A (0.65) | CYP2C19CYP2D6INPP5DCDC25APOLA1 | |
| SCHEMBL17817547 | 0.91 | CYP2C19 (0.57) | CYP2C19CYP2D6INPP5DCDC25APOLA1 | |
| SCHEMBL9580404 | 0.88 | BCHE (0.68) | CYP2C19CYP2D6INPP5DCDC25APOLA1 | |
| SCHEMBL18541412 | 0.88 | BCHE (0.68) | CYP2C19CYP2D6INPP5DCDC25APOLA1 | |
| SCHEMBL2553921 | 0.88 | BCHE (0.68) | CYP2C19CYP2D6INPP5DCDC25APOLA1 | |
| SCHEMBL21206235 | 0.88 | BCHE (0.68) | CYP2C19CYP2D6INPP5DCDC25APOLA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6288041-B1 | Sialic acid derivatives | MITSUBISHI CHEMICAL CORPORATION (JP) | 2001-09-11 | — | — | US | disclosed |
| EP-0837070-A1 | SIALIC ACID DERIVATIVES | MITSUBISHI CHEMICAL CORPORATION (JP) | 1998-04-22 | — | — | EP | disclosed |