Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 5/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | CASP1 | P29466 | 2/20 | 0.48 |
| ▸ | CASP7 | P55210 | 2/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | HBB | P68871 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | NQO2 | P16083 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Benz(B)Anthracene SCHEMBL28591666 | 0.96 | ALDH1A1 (0.52) | CYP2A6ALOX12ALDH1A1HSD17B10CYP3A4 | |
| Anthracene SCHEMBL29352043 | 0.88 | CYP2A6 (0.64) | CYP2A6ALOX12ALDH1A1HSD17B10CYP3A4 | |
| Anthracene SCHEMBL2833889 | 0.88 | CYP2A6 (0.64) | CYP2A6ALOX12ALDH1A1HSD17B10CYP3A4 | |
| Anthracene SCHEMBL5713429 | 0.88 | CYP2A6 (0.64) | CYP2A6ALOX12ALDH1A1HSD17B10CYP3A4 | |
| Anthracene SCHEMBL7703 | 0.88 | CYP2A6 (0.64) | CYP2A6ALOX12ALDH1A1HSD17B10CYP3A4 | |
| Anthracene SCHEMBL23302274 | 0.84 | CYP2A6 (0.58) | CYP2A6ALOX12ALDH1A1HSD17B10CYP3A4 | |
| Anthracene SCHEMBL7621971 | 0.84 | CYP2A6 (0.58) | CYP2A6ALOX12ALDH1A1HSD17B10CYP3A4 | |
| Anthracene SCHEMBL1395160 | 0.84 | CYP2A6 (0.58) | CYP2A6ALOX12ALDH1A1HSD17B10CYP3A4 | |
| SCHEMBL22634171 | 0.84 | ALDH1A1 (0.61) | CYP2A6ALOX12ALDH1A1HSD17B10CYP3A4 | |
| Benz(B)Anthracene SCHEMBL22352910 | 0.84 | ALDH1A1 (0.61) | CYP2A6ALOX12ALDH1A1HSD17B10CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1057809-A1 | Carbonate derivatives of retinol, process for their preparation and utilisations | L'OREAL (FR) | 2000-12-06 | — | — | EP | disclosed |