Niacinamide

Niacinamide

SCHEMBL7260668

NC(=O)c1cccnc1.O=C(O)C1CCCCC1

nearest known ligand 0.65

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F7 P08709 1/20 0.65
F3 P13726 1/20 0.65
SARM1 Q6SZW1 1/20 0.65
SIRT2 Q8IXJ6 1/20 0.65
SIRT6 Q8N6T7 1/20 0.65
SIRT1 Q96EB6 1/20 0.65
SIRT3 Q9NTG7 1/20 0.65
SIRT5 Q9NXA8 1/20 0.65
SIRT4 Q9Y6E7 1/20 0.65
ALDH1A1 P00352 4/20 0.49
APP P05067 1/20 0.49
GAA P10253 1/20 0.49
HCAR3 P49019 1/20 0.49
HCAR2 Q8TDS4 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.48
NPSR1 Q6W5P4 1/20 0.47
KDM4E B2RXH2 1/20 0.46
MKNK1 Q9BUB5 2/20 0.45
MKNK2 Q9HBH9 2/20 0.45
CCNA2 P20248 1/20 0.44

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
Niacinamide SCHEMBL5712752 0.86 F7 (0.88) F7F3SARM1SIRT2SIRT6
Niacinamide SCHEMBL28189033 0.84 F7 (0.67) F7F3SARM1SIRT2SIRT6
Benzamide SCHEMBL5849105 0.82 POLB (0.59) GAASMN1; SMN2
Niacinamide SCHEMBL675207 0.82 F7 (0.96) F7F3SARM1SIRT2SIRT6
SCHEMBL27587059 0.81 HCAR2 (0.42) F7F3SARM1SIRT2SIRT6
Niacinamide SCHEMBL29624874 0.80
Niacinamide SCHEMBL460466 0.80 F7 (1.00) F7F3SARM1SIRT2SIRT6
Niacinamide SCHEMBL19978192 0.80
Niacinamide SCHEMBL2926 0.80
SCHEMBL5046019 0.80 SLC18A3 (0.54) F7F3SARM1SIRT2SIRT6

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
WO-2003099812-A1 PHENYL-FURAN OR PHENYL-THIOPHENE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS MEDICINE PIERRE FABRE MEDICAMENT (FR) 2003-12-04 WO claimed