Demannose

Demannose

SCHEMBL4801479

O=C(O)c1ccc(O)cc1.O=C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.48
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA3 P07451 1/20 0.48
TYR P14679 1/20 0.48
DRD1 P21728 1/20 0.48
CA4 P22748 1/20 0.48
CA6 P23280 1/20 0.48
CA5A P35218 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
CA14 Q9ULX7 1/20 0.48
CA5B Q9Y2D0 1/20 0.48
SRD5A2 P31213 1/20 0.44
ALDH1A1 P00352 3/20 0.37
PDE4A P27815 1/20 0.37
TP53 P04637 1/20 0.36
TSHR P16473 1/20 0.36
L3MBTL1 Q9Y468 3/20 0.35
LMNA P02545 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
Terephthalic Acid SCHEMBL28435881 0.94 TSHR (0.41) CA2CA12CA1CA3TYR
Demannose SCHEMBL28138394 0.89 LMNA (0.42) ALDH1A1PDE4ATSHRL3MBTL1LMNA
Galactose SCHEMBL16210938 0.89 LMNA (0.42) ALDH1A1PDE4ATSHRL3MBTL1LMNA
Demannose SCHEMBL1996276 0.89 LMNA (0.42) ALDH1A1PDE4ATSHRL3MBTL1LMNA
Demannose SCHEMBL15797656 0.88 USP2 (0.39) CA2CA12CA1CA3TYR
Demannose SCHEMBL11356881 0.88 TSHR (0.45) SRD5A2ALDH1A1PDE4ATP53TSHR
Demannose SCHEMBL27769187 0.88 TSHR (0.45) SRD5A2ALDH1A1PDE4ATP53TSHR
Demannose SCHEMBL3515070 0.84 TDP1 (0.38) CA2CA12CA1CA3CA4
Demannose SCHEMBL27735211 0.84 TDP1 (0.38) CA2CA12CA1CA3CA4
Xylose SCHEMBL31303135 0.83 TSHR (0.47) SRD5A2ALDH1A1PDE4ATP53TSHR

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-7435556-B2 Method for increasing the ratio of p-hydroxybenzoic acid ester glucoside to total p-hydroxybenzoic acid glucose conjugates in p-hydroxybenzoic acid-producing microorganisms and green plant cells E.I. DU PONT DE NEMOURS AND COMPANY (US) 2008-10-14 US disclosed