Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.67 |
| ▸ | PPARG | P37231 | 1/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | CCR2 | P41597 | 2/20 | 0.44 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 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 | |
|---|---|---|---|---|
| SCHEMBL11167391 | 0.91 | CYP2C9 (0.78) | CYP2C9PPARGALDH1A1GAAPKM | |
| SCHEMBL11168591 | 0.91 | CYP2C9 (0.66) | CYP2C9PPARGALDH1A1GAAPKM | |
| Hydrochloric Acid SCHEMBL11168599 | 0.90 | CYP2C9 (0.76) | CYP2C9PPARGALDH1A1GAAPKM | |
| SCHEMBL11162761 | 0.89 | CYP2C9 (0.61) | CYP2C9PPARGALDH1A1GAAPKM | |
| SCHEMBL11175640 | 0.89 | CYP2C9 (0.60) | CYP2C9PPARGALDH1A1GAAPKM | |
| SCHEMBL11163993 | 0.88 | CYP2C9 (0.62) | CYP2C9PPARGALDH1A1GAAPKM | |
| SCHEMBL11162817 | 0.85 | CYP2C9 (0.56) | CYP2C9PPARGALDH1A1GAAPKM | |
| SCHEMBL11160841 | 0.82 | AKR1B1 (0.58) | CYP2C9PPARGALDH1A1GAAPKM | |
| SCHEMBL11169969 | 0.79 | ALDH1A1 (0.59) | CYP2C9PPARGALDH1A1GAAPKM | |
| SCHEMBL11171563 | 0.76 | CYP2C9 (0.72) | CYP2C9PPARGALDH1A1GAAPKM |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4393062-A | ALDOSE REDUCTASE INHIBITOR | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1983-07-12 | — | — | US | disclosed |
| EP-0002895-B1 | ENZYME INHIBITORY PHTHALAZIN-4-YLACETIC ACID DERIVATIVES, PHARMACEUTICAL COMPOSITIONS THEREOF, AND PROCESS FOR THEIR MANUFACTURE | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1981-10-14 | — | — | EP | disclosed |
| US-4251528-A | ALDOSE REDUCTASE INHIBITORS USEFUL IN DIABETES, GALACTOSEMIA | IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) | 1981-02-17 | — | — | US | disclosed |