Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 4/20 | 0.53 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.53 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.53 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.37 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8805641 | 0.90 | AKR1B1 (0.52) | AKR1B1AKR1B10AKR1A1CHRM5 | |
| SCHEMBL8322894 | 0.89 | AKR1B1 (0.54) | AKR1B1AKR1B10AKR1A1 | |
| SCHEMBL8805046 | 0.87 | AKR1B1 (0.54) | AKR1B1AKR1B10AKR1A1CHRM5GRM5 | |
| SCHEMBL8327047 | 0.84 | AKR1B1 (0.51) | AKR1B1AKR1B10AKR1A1CHRM5GRM5 | |
| SCHEMBL9728938 | 0.83 | AKR1B1 (0.50) | AKR1B1AKR1B10AKR1A1CHRM5GRM5 | |
| SCHEMBL9385128 | 0.81 | AKR1B1 (0.45) | AKR1B1AKR1B10AKR1A1CHRM5 | |
| SCHEMBL9728944 | 0.80 | AKR1B1 (0.47) | AKR1B1AKR1B10AKR1A1 | |
| SCHEMBL8319660 | 0.79 | AKR1B1 (0.54) | AKR1B1AKR1B10AKR1A1CHRM5 | |
| SCHEMBL9383416 | 0.78 | AKR1B1 (0.44) | AKR1B1AKR1B10AKR1A1CHRM5 | |
| SCHEMBL8805167 | 0.77 | AKR1B1 (0.53) | AKR1B1AKR1B10AKR1A1CHRM5 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0519600-B1 | Process and intermediate for making isoquinoline derivatives | AMERICAN HOME PROD (US) | 1997-06-11 | — | — | EP | disclosed |
| EP-0519600-A1 | Process and intermediate for making isoquinoline derivatives | AMERICAN HOME PRODUCTS CORPORATION (US) | 1992-12-23 | — | — | EP | disclosed |
| US-5169948-A | Process and intermediates for the preparation of spiro[isoquinoline-4(1H),3-pyrrolidine]1,2,3,5 (2H)-tetrones which are useful as aldose reductase inhibitors | AMERICAN HOME PRODUCTS CORPORATION (US) | 1992-12-08 | — | — | US | disclosed |
| US-5106978-A | Process and intermediates for the preparation of spiro(isoquinoline-4(1H), 3'-pyrrolidine)-1,2', 3,5'(2H)-tetrones which are useful as aldose reductase inhibitors | AMERICAN HOME PRODUCTS CORPORATION (US) | 1992-04-21 | — | — | US | disclosed |