Niacinamide

Niacinamide

SCHEMBL15939571

NC(=O)c1cccnc1.Nc1nc(P(=O)(O)O)nc2nc[nH]c12

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ F7 P08709 1/20 0.48
▸ F3 P13726 1/20 0.48
▸ SARM1 Q6SZW1 1/20 0.48
▸ SIRT2 Q8IXJ6 1/20 0.48
▸ SIRT6 Q8N6T7 1/20 0.48
▸ SIRT1 Q96EB6 1/20 0.48
▸ SIRT3 Q9NTG7 1/20 0.48
▸ SIRT5 Q9NXA8 1/20 0.48
▸ SIRT4 Q9Y6E7 1/20 0.48
▸ NEK2 P51955 2/20 0.39
▸ PDPK1 O15530 1/20 0.38
▸ GDA Q9Y2T3 1/20 0.38
▸ KDR P35968 1/20 0.38
▸ AURKB Q96GD4 1/20 0.38
▸ CCNA2 P20248 1/20 0.37
▸ CDK2 P24941 1/20 0.37
▸ ATR Q13535 2/20 0.37
▸ MKNK1 Q9BUB5 2/20 0.36
▸ CHEK2 O96017 1/20 0.35
▸ MKNK2 Q9HBH9 1/20 0.35

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 SCHEMBL15939570 0.83 F7 (0.48) F7F3SARM1SIRT2SIRT6
Adenine SCHEMBL1408059 0.82 PI4KA (0.50) F7F3SARM1SIRT2SIRT6
Adenine SCHEMBL27528672 0.82 PI4KA (0.50) F7F3SARM1SIRT2SIRT6
SCHEMBL27586020 0.81 PDPK1 (0.56) PDPK1GDAKDRAURKBCDK2
SCHEMBL2698567 0.81 PDPK1 (0.56) PDPK1GDAKDRAURKBCDK2
Adenine SCHEMBL2564210 0.79 PI4KA (0.55) F7F3SARM1SIRT2SIRT6
Adenine SCHEMBL15700 0.79 PI4KA (0.55) F7F3SARM1SIRT2SIRT6
Adenine SCHEMBL22748487 0.79 PI4KA (0.55) F7F3SARM1SIRT2SIRT6
Adenine SCHEMBL755727 0.79 PI4KA (0.46) F7F3SARM1SIRT2SIRT6
Adenine SCHEMBL23531102 0.78 PI4KA (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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10006039-B2 Production of oil in vegetative tissues BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2018-06-26 — — US disclosed
US-20140228585-A1 PRODUCTION OF OIL IN VEGETATIVE TISSUES BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2014-08-14 — — US disclosed
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