Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.58 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.57 |
| ▸ | GAA | P10253 | 2/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | VCAM1 | P19320 | 2/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | CA1 | P00915 | 2/20 | 0.51 |
| ▸ | CA2 | P00918 | 2/20 | 0.51 |
| ▸ | CA12 | O43570 | 1/20 | 0.51 |
| ▸ | CA9 | Q16790 | 1/20 | 0.51 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.51 |
| ▸ | CES1 | P23141 | 1/20 | 0.50 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.49 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL6746532 | 0.85 | TDP1 (0.63) | ALDH1A1TDP1MAPTSRD5A2GAA | |
| SCHEMBL1758305 | 0.82 | HSD17B1 (0.59) | MAPTSRD5A2LMNAVCAM1MAPK1 | |
| SCHEMBL140502 | 0.81 | HSD17B10 (0.67) | ALDH1A1TDP1MAPTGAALMNA | |
| SCHEMBL8814597 | 0.81 | GAA (0.67) | ALDH1A1TDP1MAPTSRD5A2GAA | |
| SCHEMBL12490391 | 0.81 | TDP1 (0.77) | ALDH1A1TDP1MAPTSRD5A2GAA | |
| SCHEMBL8626291 | 0.81 | VCAM1 (0.84) | ALDH1A1TDP1MAPTSRD5A2GAA | |
| SCHEMBL10723714 | 0.80 | SRD5A2 (0.83) | ALDH1A1TDP1MAPTSRD5A2GAA | |
| SCHEMBL975118 | 0.80 | SRD5A2 (0.83) | ALDH1A1TDP1MAPTSRD5A2GAA | |
| SCHEMBL14353306 | 0.79 | HSD17B10 (0.64) | ALDH1A1TDP1MAPTGAALMNA | |
| SCHEMBL9735776 | 0.79 | SRD5A2 (0.63) | ALDH1A1TDP1MAPTSRD5A2GAA |
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-4323691-A | Hydroxyaminomethyl derivatives of benzoyl di-substituted α-phenoxyalkanoyl esters | ABBOTT LABORATORIES (US) | 1982-04-06 | — | — | US | disclosed |