Known targets — ChEMBL curated mechanism
ACHECHRM1CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNG
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 | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.88 |
| ▸ | TSHR | P16473 | 1/20 | 0.88 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 2/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | AKT1 | P31749 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | TNKS | O95271 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
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 SCHEMBL2004101 | 0.97 | — | — | |
| Styrene SCHEMBL28605772 | 0.97 | ALDH1A1 (0.93) | ALDH1A1TSHRHDAC8TDP1TP53 | |
| Styrene SCHEMBL3312123 | 0.97 | — | — | |
| Styrene SCHEMBL28190740 | 0.94 | ALDH1A1 (0.88) | ALDH1A1TSHRHDAC8TDP1TP53 | |
| Styrene SCHEMBL28190073 | 0.94 | ALDH1A1 (0.88) | ALDH1A1TSHRHDAC8TDP1TP53 | |
| Styrene SCHEMBL29201873 | 0.94 | ALDH1A1 (0.88) | ALDH1A1TSHRHDAC8TDP1TP53 | |
| Styrene SCHEMBL29213087 | 0.94 | ALDH1A1 (0.88) | ALDH1A1TSHRHDAC8TDP1TP53 | |
| Styrene SCHEMBL10892600 | 0.94 | ALDH1A1 (1.00) | ALDH1A1TSHRHDAC8TDP1TP53 | |
| Styrene SCHEMBL4986035 | 0.94 | ALDH1A1 (1.00) | ALDH1A1TSHRHDAC8TDP1TP53 | |
| Styrene SCHEMBL6258482 | 0.94 | ALDH1A1 (1.00) | ALDH1A1TSHRHDAC8TDP1TP53 |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108440485-B | Production method of cyclic carbonate | 中国科学院大连化学物理研究所 | 2021-06-01 | — | — | CN | claimed |
| CN-108440488-B | Organic porous copolymer multifunctional bionic heterogeneous catalyst and preparation method thereof | 中国科学院大连化学物理研究所 | 2021-06-01 | — | — | CN | claimed |
| CN-112403451-A | Porous sludge dye adsorbent and preparation method thereof | 湖南长重机器股份有限公司 | 2021-02-26 | — | — | CN | claimed |
| CN-107537564-B | Heterogeneous catalyst containing quaternary phosphonium salt-phosphorus ligand organic porous copolymer and preparation and application thereof | 中国科学院大连化学物理研究所 | 2020-04-07 | — | — | CN | claimed |
| CN-108440488-A | A kind of Porous-Organic copolymer multifunctional bionic heterogeneous catalyst and preparation method thereof | 中国科学院大连化学物理研究所 | 2018-08-24 | — | — | CN | claimed |
| CN-108440485-A | A kind of production method of cyclic carbonate ester | 中国科学院大连化学物理研究所 | 2018-08-24 | — | — | CN | claimed |
| CN-107537564-A | Han quaternary alkylphosphonium salts phosphorus part Porous-Organic copolymer heterogeneous catalyst and its preparation and application | 中国科学院大连化学物理研究所 | 2018-01-05 | — | — | CN | claimed |
| CN-112403451-B | Porous sludge dye adsorbent and preparation method thereof | 湖南长重机器股份有限公司 | 2022-08-05 | — | — | CN | disclosed |
| CN-108440488-B | Organic porous copolymer multifunctional bionic heterogeneous catalyst and preparation method thereof | 中国科学院大连化学物理研究所 | 2021-06-01 | — | — | CN | disclosed |
| CN-112403451-A | Porous sludge dye adsorbent and preparation method thereof | 湖南长重机器股份有限公司 | 2021-02-26 | — | — | CN | disclosed |
| CN-107537564-B | Heterogeneous catalyst containing quaternary phosphonium salt-phosphorus ligand organic porous copolymer and preparation and application thereof | 中国科学院大连化学物理研究所 | 2020-04-07 | — | — | CN | disclosed |
| CN-108440488-A | A kind of Porous-Organic copolymer multifunctional bionic heterogeneous catalyst and preparation method thereof | 中国科学院大连化学物理研究所 | 2018-08-24 | — | — | CN | disclosed |
| CN-107537564-A | Han quaternary alkylphosphonium salts phosphorus part Porous-Organic copolymer heterogeneous catalyst and its preparation and application | 中国科学院大连化学物理研究所 | 2018-01-05 | — | — | CN | disclosed |