Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 9/20 | 0.66 |
| ▸ | VKORC1 | Q9BQB6 | 3/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | ALB | P02768 | 1/20 | 0.49 |
| ▸ | PCSK7 | Q16549 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | NQO1 | P15559 | 2/20 | 0.47 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| Phenprocoumon SCHEMBL29392123 | 0.80 | CYP2C9 (1.00) | CYP2C9VKORC1HSD17B10KDM4EALDH1A1 | |
| Phenprocoumon SCHEMBL24500477 | 0.80 | CYP2C9 (1.00) | CYP2C9VKORC1HSD17B10KDM4EALDH1A1 | |
| Phenprocoumon SCHEMBL43031 | 0.80 | CYP2C9 (1.00) | CYP2C9VKORC1HSD17B10KDM4EALDH1A1 | |
| Phenprocoumon SCHEMBL24500472 | 0.80 | CYP2C9 (1.00) | CYP2C9VKORC1HSD17B10KDM4EALDH1A1 | |
| SCHEMBL7354719 | 0.76 | CYP2C9 (0.58) | CYP2C9VKORC1HSD17B10KDM4EALDH1A1 | |
| SCHEMBL7357584 | 0.75 | CYP2C9 (0.76) | CYP2C9VKORC1HSD17B10KDM4EALDH1A1 | |
| SCHEMBL7355347 | 0.74 | CYP2C9 (0.74) | CYP2C9VKORC1HSD17B10KDM4EALDH1A1 | |
| SCHEMBL7351110 | 0.74 | CYP2C9 (0.87) | CYP2C9VKORC1HSD17B10KDM4EALDH1A1 | |
| SCHEMBL7359848 | 0.73 | CYP2C9 (0.72) | CYP2C9VKORC1HSD17B10KDM4EALDH1A1 | |
| SCHEMBL13478402 | 0.73 | KDM4E (0.58) | CYP2C9HSD17B10KDM4EALDH1A1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1117291-A | 4-Hydroxy-pyran-2-one derivatives for the treatment of retroviral infections | UPJOHN CO (US) | 1996-02-21 | — | — | CN | disclosed |