Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.31 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.31 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.30 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 2/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | RGS12 | O14924 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | GMNN | O75496 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL11661768 | 0.78 | ALDH1A1 (0.40) | ALDH1A1PTGS1PTGS2TP53TDP1 | |
| SCHEMBL10896146 | 0.78 | TP53 (0.42) | ALDH1A1PTGS1PTGS2TP53TDP1 | |
| SCHEMBL25665110 | 0.76 | PTGS1 (0.43) | ALDH1A1PTGS1PTGS2TP53TDP1 | |
| SCHEMBL666188 | 0.76 | ALDH1A1 (0.55) | ALDH1A1PTGS1PTGS2TP53TDP1 | |
| SCHEMBL6806726 | 0.76 | ALDH1A1 (0.39) | ALDH1A1PTGS1PTGS2TP53TDP1 | |
| SCHEMBL10866841 | 0.74 | SLC6A2 (0.39) | ALDH1A1PTGS1PTGS2TP53TDP1 | |
| SCHEMBL1204171 | 0.73 | TP53 (0.42) | ALDH1A1PTGS1PTGS2TP53TDP1 | |
| SCHEMBL7895817 | 0.73 | ALDH1A1 (0.50) | ALDH1A1TP53TDP1TRPA1MAPT | |
| SCHEMBL9885339 | 0.73 | TRPA1 (0.53) | ALDH1A1PTGS1PTGS2TP53TRPA1 | |
| SCHEMBL8722923 | 0.72 | TDP1 (0.45) | ALDH1A1PTGS1PTGS2TP53TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-61285207-A | — | — | None | — | — | JP | disclosed |
| JP-S61285207-A | NOVEL HIGH POLYMER COMPRISING TERT-BUTYL-P-VINYLPHENYL SULFIDE AS CONSTITUENT COMPONENT | SEITETSU KAGAKU CO LTD | 1986-12-16 | — | — | JP | disclosed |