Niacinamide

Niacinamide

SCHEMBL8508206

NC(=O)c1cccnc1.Nc1nc2ncnc(N)c2[nH]1

nearest known ligand 0.54

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ F7 P08709 1/20 0.54
▸ F3 P13726 1/20 0.54
▸ SARM1 Q6SZW1 1/20 0.54
▸ SIRT2 Q8IXJ6 1/20 0.54
▸ SIRT6 Q8N6T7 1/20 0.54
▸ SIRT1 Q96EB6 1/20 0.54
▸ SIRT3 Q9NTG7 1/20 0.54
▸ SIRT5 Q9NXA8 1/20 0.54
▸ SIRT4 Q9Y6E7 1/20 0.54
▸ PI4KA P42356 5/20 0.45
▸ PI4K2B Q8TCG2 5/20 0.45
▸ PI4K2A Q9BTU6 5/20 0.45
▸ PI4KB Q9UBF8 5/20 0.45
▸ DNMT3B Q9UBC3 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.44
▸ PNP P00491 2/20 0.41
▸ EGFR P00533 1/20 0.41
▸ SRC P12931 1/20 0.41
▸ KDR P35968 1/20 0.41
▸ ADORA2A P29274 1/20 0.40

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 SCHEMBL3281893 0.88 ADORA2A (0.58) F7F3SARM1SIRT2SIRT6
Niacinamide SCHEMBL8508202 0.84 F7 (0.55) F7F3SARM1SIRT2SIRT6
SCHEMBL10870623 0.82 HDAC1 (0.48) PI4KAPI4K2BPI4K2API4KBDNMT3B
Niacinamide SCHEMBL8510810 0.81 PI4KA (0.44) F7F3SARM1SIRT2SIRT6
Adenine SCHEMBL15700 0.81 PI4KA (0.55) F7F3SARM1SIRT2SIRT6
Adenine SCHEMBL22748487 0.81 PI4KA (0.55) F7F3SARM1SIRT2SIRT6
Adenine SCHEMBL2564210 0.81 PI4KA (0.55) F7F3SARM1SIRT2SIRT6
Adenine SCHEMBL23531102 0.81 PI4KA (0.54) F7F3SARM1SIRT2SIRT6
Adenine SCHEMBL7712108 0.81 PI4KA (0.54) F7F3SARM1SIRT2SIRT6
Adenine SCHEMBL11807683 0.81 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5965106-A ADMINISTERING TARGETING MOIETY COUPLED TO AFFINITY COMPONENT, WHEREIN TARGETING MOIETY HAS AFFINITY FOR BINDING SITES IN TARGET AREA, AND BINDING PARTNER TO AFFINITY COMPONENT COUPLED TO FUNCTIONAL MOIETY TO LOCALIZE FUNCTIONAL MOIETY IN TARGET PERIMMUNE HOLDINGS, INC. (US) 1999-10-12 — — US disclosed
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