Methane

Methane

SCHEMBL1237673

C.NC(CCOS(=O)(=O)O)C(=O)O

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PMP22 Q01453 2/20 0.46
GSR P00390 2/20 0.43
GRM8 O00222 1/20 0.43
GRM6 O15303 1/20 0.43
GRIN2D O15399 1/20 0.43
GRIN3B O60391 1/20 0.43
CYP1A2 P05177 1/20 0.43
GRIK1 P39086 1/20 0.43
GRM5 P41594 1/20 0.43
GRIA1 P42261 1/20 0.43
GRIA2 P42262 1/20 0.43
GRIA3 P42263 1/20 0.43
SLC1A3 P43003 1/20 0.43
SLC1A2 P43004 1/20 0.43
SLC1A1 P43005 1/20 0.43
GRIA4 P48058 1/20 0.43
GRIN1 Q05586 1/20 0.43
GRIN2A Q12879 1/20 0.43
GRIK2 Q13002 1/20 0.43
GRIK3 Q13003 1/20 0.43

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
SCHEMBL21933072 0.98 PMP22 (0.47) PMP22GSRGRM8GRM6GRIN2D
SCHEMBL15390311 0.77 PMP22 (0.43) PMP22GSRGRM8GRM6GRIN2D
SCHEMBL1237670 0.77 PMP22 (0.47) PMP22GSRGRM8GRM6GRIN2D
SCHEMBL4314030 0.77 PTGS1 (0.41) PMP22GSRGRM8GRM6GRIN2D
SCHEMBL2289857 0.77 PTGS1 (0.41) PMP22GSRGRM8GRM6GRIN2D
SCHEMBL15868141 0.73 GABRR1 (0.45) CYP1A2BLM
Glutamic Acid SCHEMBL28734776 0.73 GRM8 (0.60) PMP22GSRGRM8GRM6GRIN2D
SCHEMBL16845640 0.72
Canaline SCHEMBL308405 0.72
Canaline SCHEMBL440859 0.72

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
WO-2011021717-A2 METHOD FOR PRODUCING HYDROXYLATED AMINO ACIDS AJINOMOTO CO.,INC. (JP) 2011-02-24 WO disclosed