3-Nitro-Cinnamic Acid

3-Nitro-Cinnamic Acid

SCHEMBL7990710

O=C(O)C=Cc1cccc([N+](=O)[O-])c1.[NaH]

nearest known ligand 0.71

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.71
MAOB P27338 1/20 0.71
NFE2L2 Q16236 1/20 0.68
ALDH1A1 P00352 3/20 0.61
MEN1 O00255 2/20 0.61
KMT2A Q03164 2/20 0.61
FBP1 P09467 1/20 0.61
VCP P55072 1/20 0.61
CYP19A1 P11511 1/20 0.61
HSP90AA1 P07900 3/20 0.60
MITF O75030 1/20 0.60
LMNA P02545 1/20 0.60
HTT P42858 1/20 0.60
ATM Q13315 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
TRPM8 Q7Z2W7 1/20 0.59
ITGB2 P05107 1/20 0.58
ICAM1 P05362 1/20 0.58
ITGAL P20701 1/20 0.58
TGM2 P21980 1/20 0.58

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
3-Nitro-Cinnamic Acid SCHEMBL426380 0.98 MAPT (0.73) MAPTMAOBNFE2L2ALDH1A1MEN1
3-Nitro-Cinnamic Acid SCHEMBL3290556 0.98 MAPT (0.73) MAPTMAOBNFE2L2ALDH1A1MEN1
3-Nitro-Cinnamic Acid SCHEMBL4179178 0.98 MAPT (0.73) MAPTMAOBNFE2L2ALDH1A1MEN1
3-Nitro-Cinnamic Acid SCHEMBL29626695 0.98 MAPT (0.73) MAPTMAOBNFE2L2ALDH1A1MEN1
3-Nitro-Cinnamic Acid SCHEMBL448381 0.98 MAPT (0.73) MAPTMAOBNFE2L2ALDH1A1MEN1
3-Nitro-Cinnamic Acid SCHEMBL27877632 0.97 MAPT (0.71) MAPTMAOBNFE2L2ALDH1A1MEN1
3-Nitro-Cinnamic Acid SCHEMBL7401665 0.97 MAPT (0.71) MAPTMAOBNFE2L2ALDH1A1MEN1
3-Nitro-Cinnamic Acid SCHEMBL7990708 0.95 MAPT (0.69) MAPTMAOBNFE2L2ALDH1A1MEN1
SCHEMBL5209312 0.89 MAPT (0.62) MAPTMAOBNFE2L2ALDH1A1MEN1
SCHEMBL5209309 0.89 MAPT (0.62) MAPTMAOBNFE2L2ALDH1A1MEN1

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-6235731-B1 REDUCING BLOOD LIPIDS, SUGARS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-05-22 US disclosed