Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RNPEP | Q9H4A4 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MME | P08473 | 1/20 | 0.31 |
| ▸ | ACE | P12821 | 1/20 | 0.31 |
| ▸ | CPA1 | P15085 | 1/20 | 0.31 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.31 |
| ▸ | ENPEP | Q07075 | 2/20 | 0.31 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2775165 | 0.79 | TDP1 (0.46) | TP53CYP1A2TDP1 | |
| SCHEMBL25397374 | 0.79 | TDP1 (0.46) | TP53CYP1A2TDP1 | |
| SCHEMBL27076735 | 0.76 | SLC7A5 (0.48) | RNPEPENPEPSLC7A5 | |
| SCHEMBL19501038 | 0.76 | ALDH1A1 (0.35) | ALDH1A1TDP1 | |
| SCHEMBL19501034 | 0.76 | ALDH1A1 (0.35) | ALDH1A1TDP1 | |
| SCHEMBL10338810 | 0.76 | ALDH1A1 (0.35) | ALDH1A1TDP1 | |
| SCHEMBL26771564 | 0.74 | CHRM1 (0.42) | RNPEPTP53MMETDP1 | |
| SCHEMBL2574576 | 0.74 | GABRR1 (0.44) | RNPEPTP53ENPEPGABRR1CYP1A2 | |
| SCHEMBL14477582 | 0.74 | ALDH1A1 (0.33) | TP53ALDH1A1TDP1 | |
| SCHEMBL9857149 | 0.73 | RNPEP (0.31) | RNPEPSLC7A5ALDH1A1 |
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-5072023-A | Reacting lactone with ester anion to form cyclohexenone ester; oxidizing or dehydrogenating the intermediate | E. R. SQUIBB & SONS, INC. (US) | 1991-12-10 | — | — | US | disclosed |
| EP-0442495-A1 | Process for preparing highly substituted phenyls | E.R. SQUIBB & SONS, INC. (US) | 1991-08-21 | — | — | EP | disclosed |