Niacinamide

Niacinamide

SCHEMBL9150765

NC(=O)c1cccnc1.O=P(O)(O)OP(=O)(O)Oc1ncnc2nc[nH]c12

nearest known ligand 0.43

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F7 P08709 1/20 0.43
F3 P13726 1/20 0.43
SARM1 Q6SZW1 1/20 0.43
SIRT2 Q8IXJ6 1/20 0.43
SIRT6 Q8N6T7 1/20 0.43
SIRT1 Q96EB6 1/20 0.43
SIRT3 Q9NTG7 1/20 0.43
SIRT5 Q9NXA8 1/20 0.43
SIRT4 Q9Y6E7 1/20 0.43
MKNK1 Q9BUB5 1/20 0.40
BRD4 O60885 4/20 0.39
CYP1A2 P05177 2/20 0.37
CYP3A4 P08684 1/20 0.37
CREBBP Q92793 1/20 0.36
CDC7 O00311 1/20 0.36
DBF4 Q9UBU7 1/20 0.36
PDPK1 O15530 1/20 0.36
NT5C2 P49902 2/20 0.35
NT5E P21589 1/20 0.35
NPC1 O15118 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
Triphosphate SCHEMBL19057041 0.87 PI4KA (0.44) F7F3SARM1SIRT2SIRT6
Adenine SCHEMBL755727 0.85 PI4KA (0.46) F7F3SARM1SIRT2SIRT6
Hypoxanthine SCHEMBL9150757 0.82 SIRT2 (0.50) F7F3SARM1SIRT2SIRT6
Adenine SCHEMBL1408059 0.80 PI4KA (0.50) F7F3SARM1SIRT2SIRT6
Adenine SCHEMBL27528672 0.80 PI4KA (0.50) F7F3SARM1SIRT2SIRT6
Niacinamide SCHEMBL28907028 0.78 SIRT2 (0.47) F7F3SARM1SIRT2SIRT6
Adenine SCHEMBL15700 0.78 PI4KA (0.55) F7F3SARM1SIRT2SIRT6
Adenine SCHEMBL22748487 0.78 PI4KA (0.55) F7F3SARM1SIRT2SIRT6
Adenine SCHEMBL2564210 0.78 PI4KA (0.55) F7F3SARM1SIRT2SIRT6
Adenine SCHEMBL23531102 0.77 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0471740-B1 ENZYMES AND THEIR USE IN DRUG DETECTION BRITISH TECH GROUP (GB) 1995-08-09 EP disclosed
US-5387515-A Oxidation in the presence of the enzyme and cofactor nadp BRITISH TECHNOLOGY GROUP LIMITED (GB) 1995-02-07 US disclosed
US-5298414-A Polypeptides, oxidation for detection BRITISH TECHNOLOGY GROUP LIMITED (GB) 1994-03-29 US disclosed