Niacinamide

Niacinamide

SCHEMBL6918787

NC(=O)c1cccnc1.NC(=O)c1cccnc1.O=C(O)CC(OC(=O)CC(O)(C(=O)O)C(O)C(=O)O)(C(=O)O)C(O)C(=O)O

nearest known ligand 0.44

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F7 P08709 1/20 0.44
F3 P13726 1/20 0.44
SARM1 Q6SZW1 1/20 0.44
SIRT2 Q8IXJ6 1/20 0.44
SIRT6 Q8N6T7 1/20 0.44
SIRT1 Q96EB6 1/20 0.44
SIRT3 Q9NTG7 1/20 0.44
SIRT5 Q9NXA8 1/20 0.44
SIRT4 Q9Y6E7 1/20 0.44
CPT2 P23786 1/20 0.39
ACLY P53396 1/20 0.39
LMNA P02545 3/20 0.38
KMT2A Q03164 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
ALDH1A1 P00352 4/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
APP P05067 1/20 0.34
GAA P10253 1/20 0.34
HCAR3 P49019 1/20 0.34

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 SCHEMBL580103 0.87 F7 (0.55) F7F3SARM1SIRT2SIRT6
Niacin SCHEMBL811549 0.78 ALDH1A1 (0.55) F7F3SARM1SIRT2SIRT6
Niacinamide SCHEMBL31098926 0.73 F7 (0.51) F7F3SARM1SIRT2SIRT6
Citric Acid SCHEMBL5352836 0.73 F7 (0.65) F7F3SARM1SIRT2SIRT6
Niacinamide SCHEMBL5354739 0.72 F7 (0.55) F7F3SARM1SIRT2SIRT6
Niacin SCHEMBL5465552 0.69 ALDH1A1 (0.49) CPT2ACLYLMNAKMT2ATDP1
Cadaverine Tartrate SCHEMBL27679158 0.68 F7 (0.76) F7F3SARM1SIRT2SIRT6
Cadaverine Tartrate SCHEMBL29103712 0.68 F7 (0.76) F7F3SARM1SIRT2SIRT6
Niacinamide SCHEMBL580180 0.68 F7 (0.65) F7F3SARM1SIRT2SIRT6
Niacinamide SCHEMBL29011862 0.68 F7 (0.65) 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
US-20040185069-A1 Hydroxycitric acid derivatives for body slimming and tone firming compositions GUPTA SHYAM K (US) 2004-09-23 US disclosed