Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 5/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | CASP1 | P29466 | 2/20 | 0.48 |
| ▸ | CASP7 | P55210 | 2/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | HBB | P68871 | 1/20 | 0.48 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.39 |
| ▸ | NQO2 | P16083 | 1/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3465676 | 1.00 | CYP2A6 (0.50) | CYP2A6ALDH1A1HSD17B10HIF1ATDP1 | |
| SCHEMBL5008807 | 1.00 | CYP2A6 (0.50) | CYP2A6ALDH1A1HSD17B10HIF1ATDP1 | |
| SCHEMBL9097204 | 1.00 | CYP2A6 (0.50) | CYP2A6ALDH1A1HSD17B10HIF1ATDP1 | |
| SCHEMBL3259247 | 1.00 | CYP2A6 (0.50) | CYP2A6ALDH1A1HSD17B10HIF1ATDP1 | |
| SCHEMBL9095175 | 0.94 | CYP2A6 (0.55) | CYP2A6ALDH1A1HSD17B10HIF1ATDP1 | |
| SCHEMBL29374851 | 0.94 | CYP2A6 (0.55) | CYP2A6ALDH1A1HSD17B10HIF1ATDP1 | |
| Benz(B)Anthracene SCHEMBL7947 | 0.83 | ALDH1A1 (0.61) | CYP2A6ALDH1A1HSD17B10HIF1ATDP1 | |
| SCHEMBL25181 | 0.83 | ALDH1A1 (0.61) | CYP2A6ALDH1A1HSD17B10HIF1ATDP1 | |
| SCHEMBL22634171 | 0.83 | ALDH1A1 (0.61) | CYP2A6ALDH1A1HSD17B10HIF1ATDP1 | |
| Benz(B)Anthracene SCHEMBL22352910 | 0.83 | ALDH1A1 (0.61) | CYP2A6ALDH1A1HSD17B10HIF1ATDP1 |
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-20080207864-A1 | Organosilanes, Process For Production of the Same, and Use Thereof | SHARP KABUSHIKI KAISHA (JP) | 2008-08-28 | — | — | US | disclosed |