Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Styrene. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 5/20 | 0.42 |
| ▸ | CHRM2 known ✓ | P08172 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Styrene SCHEMBL28243693 | 0.96 | ALDH1A1 (0.52) | ALDH1A1TSHRACHECHRM2CHRNA7 | |
| Styrene SCHEMBL10902441 | 0.88 | ALDH1A1 (0.47) | ALDH1A1TSHRACHECHRM2CHRNA7 | |
| Styrene SCHEMBL27835963 | 0.83 | ALDH1A1 (0.74) | ALDH1A1TSHRL3MBTL1TDP1TP53 | |
| Benzene SCHEMBL28243694 | 0.82 | ALDH1A1 (0.44) | ALDH1A1TSHRACHECHRM2CHRNA7 | |
| Styrene SCHEMBL4828672 | 0.80 | ALDH1A1 (0.78) | ALDH1A1TSHRL3MBTL1TDP1TP53 | |
| Styrene SCHEMBL29712924 | 0.78 | — | — | |
| Styrene SCHEMBL587422 | 0.78 | ALDH1A1 (0.93) | ALDH1A1TSHRL3MBTL1TDP1TP53 | |
| Styrene SCHEMBL11416235 | 0.78 | — | — | |
| Styrene SCHEMBL28407802 | 0.78 | ALDH1A1 (0.93) | ALDH1A1TSHRL3MBTL1TDP1TP53 | |
| Styrene SCHEMBL2233731 | 0.76 | ALDH1A1 (0.70) | ALDH1A1TSHRCHRNA7L3MBTL1TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107596931-A | A kind of preparation method of the multilayer microporous film based on nanoparticle self assembly | 湖北大学 | 2018-01-19 | — | — | CN | claimed |
| CN-107596931-A | A kind of preparation method of the multilayer microporous film based on nanoparticle self assembly | 湖北大学 | 2018-01-19 | — | — | CN | disclosed |