Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | ATP6V1B1 | P15313 | 1/20 | 0.35 |
| ▸ | ATP6AP1 | Q15904 | 1/20 | 0.34 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.32 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.32 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8347909 | 1.00 | ALDH1A1 (0.40) | ALDH1A1ATP6V1B1ATP6AP1KEAP1NFE2L2 | |
| SCHEMBL8345469 | 0.80 | — | — | |
| SCHEMBL8345476 | 0.80 | — | — | |
| SCHEMBL8343537 | 0.78 | — | — | |
| SCHEMBL8343531 | 0.78 | — | — | |
| SCHEMBL10793302 | 0.77 | ALDH1A1 (0.42) | ALDH1A1KEAP1NFE2L2HCAR2 | |
| SCHEMBL1033930 | 0.75 | — | — | |
| SCHEMBL10071254 | 0.75 | TRPA1 (0.33) | ALDH1A1 | |
| SCHEMBL2616616 | 0.75 | — | — | |
| SCHEMBL8050360 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5981525-A | FOR THERAPY OR PROPHYLAXIS OF OSTEOPOROSIS,TUMOURS, ULCERS, AUTOIMMUNE DISEASES, LIPIDEMIC DISORDERS, HYPERCHOLESTEROLEMIC AND ATHEROSCLEROTIC DISEASES, AIDS ALZHEIMER'S DISEASE | SMITHKLINE BEECHAM CORPORATION (US) | 1999-11-09 | — | — | US | disclosed |
| US-4576759-A | CONUUGATED NITRILES OR ACIDS | SOLVAY & CIE (SOCIETE ANONYME) (BE) | 1986-03-18 | — | — | US | disclosed |