Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.66 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.44 |
| ▸ | DPP4 | P27487 | 6/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | GRK2 | P25098 | 1/20 | 0.32 |
| ▸ | PLK1 | P53350 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6231859 | 0.95 | CYP2C9 (0.69) | CYP2C9HSD17B10MAPK1NR1I2DPP4 | |
| SCHEMBL6236665 | 0.92 | CYP2C9 (0.78) | CYP2C9HSD17B10MAPK1NR1I2DPP4 | |
| SCHEMBL6732252 | 0.92 | CYP2C9 (0.65) | CYP2C9HSD17B10MAPK1NR1I2DPP4 | |
| SCHEMBL6239158 | 0.91 | CYP2C9 (0.63) | CYP2C9HSD17B10MAPK1NR1I2DPP4 | |
| SCHEMBL6232557 | 0.89 | CYP2C9 (0.64) | CYP2C9HSD17B10MAPK1NR1I2DPP4 | |
| SCHEMBL6742171 | 0.88 | CYP2C9 (0.64) | CYP2C9HSD17B10MAPK1NR1I2DPP4 | |
| SCHEMBL7075072 | 0.85 | CYP2C9 (0.56) | CYP2C9HSD17B10MAPK1NR1I2DPP4 | |
| SCHEMBL1522705 | 0.85 | CYP2C9 (0.56) | CYP2C9HSD17B10MAPK1NR1I2DPP4 | |
| SCHEMBL6235277 | 0.84 | MAPK1 (0.59) | CYP2C9HSD17B10MAPK1NR1I2MAPT | |
| SCHEMBL6739082 | 0.83 | MAPK1 (0.67) | CYP2C9HSD17B10MAPK1NR1I2POLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004052312-A2 | ANTI-INFECTIVES | SMITHKLINE BEECHAM CORPORATION (US) | 2004-06-24 | — | — | WO | claimed |
| WO-2004052312-A2 | ANTI-INFECTIVES | SMITHKLINE BEECHAM CORPORATION (US) | 2004-06-24 | — | — | WO | disclosed |