Styrene

Styrene

SCHEMBL28030333

C=Cc1ccccc1.CCC(C)/C(=C/C(=O)O)C(=O)O

nearest known ligand 0.41

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
PTGS2 P35354 2/20 0.39
HTT P42858 1/20 0.39
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
TAS1R3 Q7RTX0 1/20 0.35
TAS1R1 Q7RTX1 1/20 0.35
AKR1C3 P42330 1/20 0.34
HPGD P15428 1/20 0.34
NPC1 O15118 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HDAC3 O15379 1/20 0.33
TNKS O95271 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC1 Q13547 1/20 0.33
HCAR2 Q8TDS4 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC10 Q969S8 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.

Compoundsimilaritytop predictedshared targets
Styrene SCHEMBL11336781 0.87 TSHR (0.42) ALDH1A1TSHRPTGS2HTTMEN1
Styrene SCHEMBL11336777 0.87 TSHR (0.42) ALDH1A1TSHRPTGS2HTTMEN1
SCHEMBL3898740 0.80 KDM4E (0.33) TSHR
Styrene SCHEMBL9378735 0.75 TSHR (0.42) ALDH1A1TSHRPTGS2MEN1KMT2A
Styrene SCHEMBL27756934 0.73 ALDH1A1 (0.64) ALDH1A1TSHRPTGS2MEN1KMT2A
Styrene SCHEMBL9067618 0.73 HTT (0.59) ALDH1A1TSHRPTGS2HTTMEN1
Styrene SCHEMBL28200948 0.72 ALDH1A1 (0.56) ALDH1A1TSHRPTGS2HTTAKR1C3
Styrene SCHEMBL27551584 0.71 ALDH1A1 (0.61) ALDH1A1TSHRMEN1KMT2ATAS1R3
Styrene SCHEMBL27500446 0.71 ALDH1A1 (0.61) ALDH1A1TSHRPTGS2HTTAKR1C3
Styrene SCHEMBL27532687 0.71 ALDH1A1 (0.61) ALDH1A1TSHRPTGS2HTTMEN1

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104981504-A Fluid repellent elastomeric barrier ANSELL LTD 2015-10-14 CN disclosed