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Acrylamide

Acrylamide

SCHEMBL28298600

C=CC(N)=O.CNC(=O)C1CNCCN1

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CHRNB2 P17787 2/20 0.38
▸ CHRNA4 P43681 2/20 0.38
▸ CHRNA7 P36544 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ FGFR4 P22455 1/20 0.34
▸ CHRNB4 P30926 1/20 0.33
▸ CHRNA3 P32297 1/20 0.33
▸ AKT2 P31751 1/20 0.30

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
SCHEMBL2415851 0.87 CHRNB2 (0.47) CHRNB2CHRNA4CHRNA7CHRNB4CHRNA3
SCHEMBL1993835 0.87 CHRNB2 (0.47) CHRNB2CHRNA4CHRNA7CHRNB4CHRNA3
SCHEMBL1991927 0.87 CHRNB2 (0.47) CHRNB2CHRNA4CHRNA7CHRNB4CHRNA3
SCHEMBL2916532 0.76 CHRNB2 (0.44) CHRNB2CHRNA4CHRNA7TSHRCHRNB4
Hydrochloric Acid SCHEMBL16099371 0.74 — —
SCHEMBL7377152 0.73 CHRNB2 (0.38) CHRNB2CHRNA4CHRNA7CHRNB4CHRNA3
SCHEMBL27980838 0.72 — —
SCHEMBL14500252 0.72 KDM4E (0.31) CHRNB2CHRNA4CHRNA7
SCHEMBL6973885 0.71 CHRNB2 (0.35) CHRNB2CHRNA4CHRNA7CHRNB4CHRNA3
SCHEMBL7765233 0.71 KMT2A (0.49) ALDH1A1TSHRAKT2

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-109851617-A Chemical entities, composition and method 润新生物公司 2019-06-07 — — CN disclosed