Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 9/20 | 0.66 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.66 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.42 |
| ▸ | TRAP1 | Q12931 | 3/20 | 0.42 |
| ▸ | HSP90B1 | P14625 | 2/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.42 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9537117 | 0.90 | AKR1B1 (0.60) | AKR1B1AKR1A1MEN1CYP1A2CYP2C9 | |
| SCHEMBL9535268 | 0.89 | AKR1B1 (0.59) | AKR1B1AKR1A1MEN1CYP1A2CYP2C9 | |
| SCHEMBL9534750 | 0.85 | AKR1B1 (0.55) | AKR1B1AKR1A1MEN1CYP1A2CYP2C9 | |
| SCHEMBL9535225 | 0.84 | AKR1B1 (0.60) | AKR1B1AKR1A1MEN1CYP1A2CYP2C9 | |
| SCHEMBL9056716 | 0.84 | AKR1B1 (0.78) | AKR1B1AKR1A1MEN1CYP1A2CYP2C9 | |
| SCHEMBL10488007 | 0.82 | AKR1B1 (0.85) | AKR1B1AKR1A1MEN1CYP1A2CYP2C9 | |
| Zenarestat SCHEMBL48959 | 0.80 | AKR1B1 (1.00) | AKR1B1AKR1A1MEN1CYP1A2CYP2C9 | |
| Zenarestat SCHEMBL30583313 | 0.80 | AKR1B1 (1.00) | AKR1B1AKR1A1MEN1CYP1A2CYP2C9 | |
| Zenarestat SCHEMBL29688249 | 0.80 | AKR1B1 (1.00) | AKR1B1AKR1A1MEN1CYP1A2CYP2C9 | |
| SCHEMBL10487834 | 0.78 | AKR1B1 (0.79) | AKR1B1AKR1A1MEN1CYP1A2CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0568540-A1 | 2,4-DIOXO-PYRIDO 2,3-d]PYRIMIDINE-3-ACETIC ACIDS AND ESTERS AND SALTS THEREOF | PFIZER INC. (US) | 1993-11-10 | — | — | EP | disclosed |
| WO-1992012979-A1 | 2,4-DIOXO-PYRIDO [2,3-d]PYRIMIDINE-3-ACETIC ACIDS AND ESTERS AND SALTS THEREOF | PFIZER INC. (US) | 1992-08-06 | — | — | WO | disclosed |