Niacinamide

Niacinamide

SCHEMBL29859929

NC(=O)c1cccnc1.OC[C@H]1OC(Cl)[C@H](O)[C@@H]1O

nearest known ligand 0.55

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ F7 P08709 1/20 0.55
▸ F3 P13726 1/20 0.55
▸ SARM1 Q6SZW1 1/20 0.55
▸ SIRT2 Q8IXJ6 1/20 0.55
▸ SIRT6 Q8N6T7 1/20 0.55
▸ SIRT1 Q96EB6 1/20 0.55
▸ SIRT3 Q9NTG7 1/20 0.55
▸ SIRT5 Q9NXA8 1/20 0.55
▸ SIRT4 Q9Y6E7 1/20 0.55
▸ MKNK1 Q9BUB5 1/20 0.40
▸ MKNK2 Q9HBH9 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.39
▸ APP P05067 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ HCAR3 P49019 1/20 0.39
▸ HCAR2 Q8TDS4 1/20 0.39
▸ SLC5A2 P31639 1/20 0.38
▸ LMNA P02545 3/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38

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 SCHEMBL21074249 1.00 F7 (0.55) F7F3SARM1SIRT2SIRT6
Ribose (Furanose) SCHEMBL18185139 0.88 F7 (0.59) F7F3SARM1SIRT2SIRT6
Ribose (Furanose) SCHEMBL14321532 0.88 F7 (0.59) F7F3SARM1SIRT2SIRT6
Ribose (Furanose) SCHEMBL338518 0.88 F7 (0.59) F7F3SARM1SIRT2SIRT6
Ribose (Furanose) SCHEMBL23111913 0.87 F7 (0.58) F7F3SARM1SIRT2SIRT6
Niacinamide SCHEMBL28731875 0.87 F7 (0.58) F7F3SARM1SIRT2SIRT6
Niacinamide SCHEMBL28185191 0.87 F7 (0.58) F7F3SARM1SIRT2SIRT6
Ribose (Furanose) SCHEMBL17315074 0.86 F7 (0.56) F7F3SARM1SIRT2SIRT6
Niacinamide SCHEMBL20398298 0.85 F7 (0.55) F7F3SARM1SIRT2SIRT6
Niacinamide SCHEMBL23111927 0.85 F7 (0.55) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115725481-A Recombinant bacterium for producing beta-nicotinamide mononucleotide, construction method thereof, method for producing beta-nicotinamide mononucleotide and application 福建师范大学 2023-03-03 — — CN disclosed
CN-114933621-A Organic acid salt of nicotinamide ribose, and crystal form, preparation method and application thereof 深圳市迪克曼生物科技有限公司 2022-08-23 — — CN disclosed
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