Acrylamide

Acrylamide

SCHEMBL27497451

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

nearest known ligand 0.69

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Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Acrylamide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.69
TSHR P16473 4/20 0.69
FGFR4 P22455 1/20 0.69
LMNA P02545 3/20 0.44
FFAR3 O14843 1/20 0.44
LCK P06239 1/20 0.44
FYN P06241 1/20 0.44
ALOX15 P16050 1/20 0.41
BLM P54132 1/20 0.41
PMP22 Q01453 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
TP53 P04637 1/20 0.37
ACHE P22303 1/20 0.35
LDHA P00338 1/20 0.32
LDHB P07195 1/20 0.32
CRBN Q96SW2 1/20 0.30
POLB P06746 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
Acrylamide SCHEMBL1310130 0.97 ALDH1A1 (0.73) ALDH1A1TSHRFGFR4LMNAFFAR3
Acrylamide SCHEMBL4947587 0.97 ALDH1A1 (0.73) ALDH1A1TSHRFGFR4LMNAFFAR3
Acrylamide SCHEMBL3708713 0.97
Acrylamide SCHEMBL28418599 0.94 ALDH1A1 (0.69) ALDH1A1TSHRFGFR4LMNAFFAR3
Acrylamide SCHEMBL9936680 0.94 ALDH1A1 (0.79) ALDH1A1TSHRFGFR4LMNAFFAR3
Acrylamide SCHEMBL35469 0.94 ALDH1A1 (0.79) ALDH1A1TSHRFGFR4LMNAFFAR3
Acrylamide SCHEMBL9304706 0.94 ALDH1A1 (0.79) ALDH1A1TSHRFGFR4LMNAFFAR3
Acrylamide SCHEMBL679118 0.94 ALDH1A1 (0.79) ALDH1A1TSHRFGFR4LMNAFFAR3
Acrylamide SCHEMBL843143 0.94
Acrylic Acid SCHEMBL19876598 0.91 TSHR (0.65) ALDH1A1TSHRFGFR4LMNAFFAR3

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
CN-1214292-C Forming method for photoresist design and its laminating products TOKYO OKA GOGYO K K (JP) 2005-08-10 CN disclosed
CN-1424626-A Forming method for photoresist design and its laminating products TOKYO OKA GOGYO K K (JP) 2003-06-18 CN disclosed