Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL4574336 | 0.78 | ALDH1A1 (0.50) | ALDH1A1TDP1 | |
| SCHEMBL6247510 | 0.74 | — | — | |
| SCHEMBL4800733 | 0.74 | — | — | |
| SCHEMBL24415092 | 0.73 | ALDH1A1 (0.50) | ALDH1A1TDP1 | |
| SCHEMBL626905 | 0.72 | ALDH1A1 (0.38) | ALDH1A1 | |
| SCHEMBL7640754 | 0.70 | — | — | |
| SCHEMBL8769303 | 0.70 | TSHR (0.33) | TDP1 | |
| SCHEMBL22918815 | 0.70 | ALDH1A1 (0.46) | ALDH1A1 | |
| SCHEMBL29245745 | 0.70 | ALDH1A1 (0.41) | ALDH1A1 | |
| SCHEMBL10636466 | 0.69 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0792258-A1 | PROCESS FOR THE EFFICIENT PREPARATION OF N-SUBSTITUTED DEHYDROAMINO ACID ESTERS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1997-09-03 | — | — | EP | claimed |
| US-5559268-A | Process for the efficient preparation of N-substituted dehydroamino acid esters | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1996-09-24 | — | — | US | claimed |
| WO-1996016021-A1 | PROCESS FOR THE EFFICIENT PREPARATION OF N-SUBSTITUTED DEHYDROAMINO ACID ESTERS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1996-05-30 | — | — | WO | claimed |
| EP-0792258-A1 | PROCESS FOR THE EFFICIENT PREPARATION OF N-SUBSTITUTED DEHYDROAMINO ACID ESTERS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1997-09-03 | — | — | EP | disclosed |
| US-5559268-A | Process for the efficient preparation of N-substituted dehydroamino acid esters | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1996-09-24 | — | — | US | disclosed |
| WO-1996016021-A1 | PROCESS FOR THE EFFICIENT PREPARATION OF N-SUBSTITUTED DEHYDROAMINO ACID ESTERS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1996-05-30 | — | — | WO | disclosed |