Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 2/20 | 0.34 |
| ▸ | SPHK1 | Q9NYA1 | 6/20 | 0.33 |
| ▸ | SPHK2 | Q9NRA0 | 5/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.31 |
| ▸ | DPP4 | P27487 | 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 | |
|---|---|---|---|---|
| SCHEMBL20612782 | 0.84 | ALDH1A1 (0.37) | ALDH1A1EPHX1BCHENOS1NOS2 | |
| SCHEMBL13288372 | 0.84 | ALDH1A1 (0.37) | ALDH1A1EPHX1BCHENOS1NOS2 | |
| SCHEMBL15456629 | 0.78 | — | — | |
| SCHEMBL19416645 | 0.75 | ALDH1A1 (0.31) | ALDH1A1NOS1NOS2 | |
| SCHEMBL18838932 | 0.75 | ALDH1A1 (0.31) | ALDH1A1NOS1NOS2 | |
| SCHEMBL7909283 | 0.74 | ALDH1A1 (0.42) | ALDH1A1EPHX1CYP1A2SMN1; SMN2SPHK1 | |
| SCHEMBL25238880 | 0.73 | SPHK1 (0.41) | ALDH1A1SPHK1SPHK2 | |
| SCHEMBL10762724 | 0.73 | ALDH1A1 (0.39) | ALDH1A1EPHX1CYP1A2SMN1; SMN2SPHK1 | |
| SCHEMBL10783535 | 0.73 | SPHK1 (0.41) | ALDH1A1EPHX1CYP1A2SMN1; SMN2SPHK1 | |
| SCHEMBL11986784 | 0.73 | THRB (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-8419972-B2 | Polymerizable liquid crystal composition | JNC CORPORATION (JP) | 2013-04-16 | — | — | US | disclosed |
| US-20100117027-A1 | Polymerizable liquid crystal composition | CHISSO CORPORATION | 2010-05-13 | — | — | US | disclosed |