Demannose

Demannose

SCHEMBL9751218

NC(N)=O.NCC(=O)O.O=C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADORA1ADORA2AADORA2BADORA3PDE3APDE3BPDE4APDE4BPDE4CPDE4D

The experimentally established mechanism targets of Demannose. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4A known ✓ P27815 1/20 0.42
USP2 O75604 1/20 0.44
SLCO1B1 Q9Y6L6 1/20 0.44
LMNA P02545 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
GLRA1 P23415 1/20 0.36
SLC6A9 P48067 1/20 0.36
OR51E2 Q9H255 1/20 0.36
AKR1B1 P15121 1/20 0.31
KDM4E B2RXH2 2/20 0.31

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
Demannose SCHEMBL9818467 0.96 USP2 (0.47) USP2SLCO1B1PDE4ALMNAL3MBTL1
Demannose SCHEMBL2293273 0.96 USP2 (0.47) USP2SLCO1B1PDE4ALMNAL3MBTL1
Demannose SCHEMBL6035884 0.96 USP2 (0.47) USP2SLCO1B1PDE4ALMNAL3MBTL1
Galactose SCHEMBL1904377 0.96 USP2 (0.47) USP2SLCO1B1PDE4ALMNAL3MBTL1
Demannose SCHEMBL22551090 0.96 USP2 (0.47) USP2SLCO1B1PDE4ALMNAL3MBTL1
Demannose SCHEMBL27664482 0.96 USP2 (0.47) USP2SLCO1B1PDE4ALMNAL3MBTL1
Demannose SCHEMBL27656022 0.96 USP2 (0.47) USP2SLCO1B1PDE4ALMNAL3MBTL1
Demannose SCHEMBL27794573 0.95 USP2 (0.46) USP2SLCO1B1PDE4ALMNAL3MBTL1
Demannose SCHEMBL3393205 0.95 USP2 (0.46) USP2SLCO1B1PDE4ALMNAL3MBTL1
Demannose SCHEMBL9751344 0.94 USP2 (0.40) USP2SLCO1B1PDE4ALMNAL3MBTL1

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-0365560-A4 RIBOFLAVIN PRODUCING STRAINS OF MICROORGANISMS, METHOD FOR SELECTING, AND METHOD FOR FERMENTATION 1991-06-26 EP disclosed
EP-0365560-A1 RIBOFLAVIN PRODUCING STRAINS OF MICROORGANISMS, METHOD FOR SELECTING, AND METHOD FOR FERMENTATION. COORS BIOTECH INC (US) 1990-05-02 EP disclosed
WO-1988009822-A1 RIBOFLAVIN PRODUCING STRAINS OF MICROORGANISMS, METHOD FOR SELECTING, AND METHOD FOR FERMENTATION COORS BIOTECH, INC. (US) 1988-12-15 WO disclosed