Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 19/20 | 0.65 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.64 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.64 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.61 |
| ▸ | MEN1 | O00255 | 1/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL9216041 | 0.88 | AKR1B1 (0.68) | AKR1B1AKR1B10AKR1A1GLO1KMT2A | |
| SCHEMBL9277880 | 0.86 | ALDH1A1 (0.62) | AKR1B1AKR1B10AKR1A1GLO1KMT2A | |
| SCHEMBL9212517 | 0.83 | KMT2A (0.79) | AKR1B1AKR1B10AKR1A1GLO1KMT2A | |
| SCHEMBL6898198 | 0.79 | AKR1B1 (1.00) | AKR1B1AKR1B10AKR1A1GLO1 | |
| Zopolrestat SCHEMBL49012 | 0.78 | AKR1B1 (1.00) | AKR1B1AKR1B10AKR1A1GLO1 | |
| SCHEMBL1589767 | 0.78 | AKR1B1 (1.00) | AKR1B1AKR1B10AKR1A1GLO1 | |
| Zopolrestat SCHEMBL29353641 | 0.78 | AKR1B1 (1.00) | AKR1B1AKR1B10AKR1A1GLO1 | |
| Zopolrestat SCHEMBL8505122 | 0.78 | AKR1B1 (1.00) | AKR1B1AKR1B10AKR1A1GLO1 | |
| Zopolrestat SCHEMBL8129027 | 0.77 | AKR1B1 (0.98) | AKR1B1AKR1B10AKR1A1GLO1 | |
| Ponalrestat SCHEMBL49154 | 0.76 | AKR1B1 (1.00) | AKR1B1KMT2AMEN1CYP1A2CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1995003053-A1 | OXOPHTHALAZINES FOR TREATING CACHEXIA | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1995-02-02 | — | — | WO | disclosed |