Styrene

Styrene

SCHEMBL4895288

C=Cc1ccccc1.CC1C/C1=C\c1ccccc1

nearest known ligand 0.54

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.54
TSHR P16473 1/20 0.54
CHRNB2 P17787 1/20 0.40
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
CHRNA4 P43681 1/20 0.40
CHRNA7 P36544 1/20 0.40
HPGD P15428 1/20 0.37
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
CYP19A1 P11511 2/20 0.36
CYP11B2 P19099 2/20 0.36
TP53 P04637 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CYP1A2 P05177 3/20 0.34
LMNA P02545 1/20 0.34
CYP2D6 P10635 1/20 0.34
MAPT P10636 1/20 0.34
CYP2C19 P33261 1/20 0.34

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 SCHEMBL693301 1.00 ALDH1A1 (0.54) ALDH1A1TSHRCHRNB2CHRNB4CHRNA3
Butadiene SCHEMBL4458837 0.90 HPGD (0.41) ALDH1A1TSHRCHRNB2CHRNB4CHRNA3
SCHEMBL118039 0.90 CHRNB2 (0.46) ALDH1A1TSHRCHRNB2CHRNB4CHRNA3
Styrene SCHEMBL16432075 0.87 ALDH1A1 (0.41) ALDH1A1TSHRCHRNB2CHRNB4CHRNA3
Acrylonitrile SCHEMBL8754554 0.84 CHRNB2 (0.37) ALDH1A1TSHRCHRNB2CHRNB4CHRNA3
Styrene SCHEMBL3414168 0.83 ALDH1A1 (0.52) ALDH1A1TSHRHPGDTP53TDP1
Bicarbonate SCHEMBL14660281 0.82 HPGD (0.41) ALDH1A1CHRNB2CHRNB4CHRNA3CHRNA4
Styrene SCHEMBL4357897 0.81 HPGD (0.49) ALDH1A1TSHRCHRNB2CHRNB4CHRNA3
SCHEMBL7939095 0.81 HPGD (0.41) ALDH1A1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL3693208 0.80 MAOB (0.44) ALDH1A1TSHRCHRNB2CHRNB4CHRNA3

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
US-7344568-B2 Tear resistant gels, composites, and liner articles APPLIED ELASTOMERICS, INC. (US) 2008-03-18 US claimed