Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 5/20 | 0.71 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.56 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.56 |
| ▸ | CHRM5 | P08912 | 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 | |
|---|---|---|---|---|
| SCHEMBL9853859 | 0.92 | AKR1B1 (0.71) | AKR1B1AKR1B10AKR1A1CHRM5 | |
| SCHEMBL9728664 | 0.91 | AKR1B1 (0.69) | AKR1B1AKR1B10AKR1A1CHRM5 | |
| SCHEMBL8323558 | 0.88 | AKR1B1 (0.71) | AKR1B1AKR1B10AKR1A1CHRM5 | |
| SCHEMBL9729022 | 0.87 | AKR1B1 (0.75) | AKR1B1AKR1B10AKR1A1 | |
| SCHEMBL8562395 | 0.85 | AKR1B1 (0.64) | AKR1B1AKR1B10AKR1A1 | |
| SCHEMBL8320547 | 0.85 | AKR1B1 (0.64) | AKR1B1AKR1B10AKR1A1 | |
| SCHEMBL8323375 | 0.84 | AKR1B1 (0.62) | AKR1B1AKR1B10AKR1A1CHRM5 | |
| SCHEMBL8806173 | 0.83 | AKR1B1 (1.00) | AKR1B1AKR1B10AKR1A1 | |
| SCHEMBL9383561 | 0.83 | AKR1B1 (1.00) | AKR1B1AKR1B10AKR1A1 | |
| SCHEMBL9383384 | 0.83 | AKR1B1 (1.00) | AKR1B1AKR1B10AKR1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0458549-A1 | N-alkyl-spiro-isoquinoline-pyrrolidine tetrones and analogs thereof useful as aldose reductase inhibitors | AMERICAN HOME PRODUCTS CORPORATION (US) | 1991-11-27 | — | — | EP | disclosed |