Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | MME | P08473 | 1/20 | 0.30 |
| ▸ | ACE | P12821 | 1/20 | 0.30 |
| ▸ | CPA1 | P15085 | 1/20 | 0.30 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10665005 | 0.76 | CYP1A2 (0.32) | ALDH1A1 | |
| SCHEMBL9447332 | 0.76 | CYP1A2 (0.32) | ALDH1A1 | |
| SCHEMBL14893044 | 0.72 | FAAH (0.37) | ALDH1A1 | |
| SCHEMBL27881348 | 0.72 | TAS1R3 (0.32) | — | |
| SCHEMBL11216881 | 0.71 | GRM2 (0.35) | ALDH1A1 | |
| SCHEMBL11210647 | 0.67 | GRM2 (0.32) | — | |
| SCHEMBL2550935 | 0.66 | CTSK (0.36) | — | |
| SCHEMBL9829180 | 0.65 | CYP1A2 (0.40) | ALDH1A1 | |
| SCHEMBL31148325 | 0.65 | ARG1 (0.37) | ALDH1A1LMNAMAPT | |
| SCHEMBL2163518 | 0.65 | CYP1A2 (0.40) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4374062-A | ASSYMETRICAL HYDROGENATION OF DEHYDROPEPTIDES USING A PHODIUM COMPLEX CATALYST | DEGUSSA AKTIENGESELLSCHAFT (DE) | 1983-02-15 | — | — | US | disclosed |