Acrylamide

Acrylamide

SCHEMBL2879989

C=CC(N)=O.CCCC(C)[N+](C)(C)C(C)(C(=O)[O-])C(=O)O

nearest known ligand 0.31

Full drug profile on Sugi Atlas →

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31
FGFR4 P22455 1/20 0.31

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
SCHEMBL278213 0.88 TSHR (0.36) TSHR
SCHEMBL3827255 0.77 CA2 (0.45)
SCHEMBL3823555 0.77 CA2 (0.45)
SCHEMBL7718260 0.77 CA2 (0.45)
SCHEMBL278738 0.76 BBOX1 (0.33)
SCHEMBL3477943 0.72 ALDH1A1 (0.35) ALDH1A1
Acetic Acid SCHEMBL6314424 0.72 CYP3A4 (0.33) TSHR
SCHEMBL9057273 0.69 BBOX1 (0.35) ALDH1A1TSHR
SCHEMBL3338797 0.69 TSHR (0.33) TSHR
Acrylamide SCHEMBL2880009 0.68 ALDH1A1 (0.34) ALDH1A1TSHRFGFR4

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7652091-B2 Improved adhesion to rubber surface, wear resistance and surface lubricity SHIN-ETSU CHEMICAL CO., LTD. (JP) 2010-01-26 US disclosed
US-20060222870-A1 Coating composition for rubber SHIN-ETSU CHEMICAL CO., LTD. (JP) 2006-10-05 US disclosed