SCHEMBL28032333

SCHEMBL28032333

CCCCCCCCCCCCCCCCCCNCCCC[C@H](N)C(=O)O.[NaH]

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.56
GRIK2 Q13002 2/20 0.56
GNAI3 P08754 1/20 0.54
GNAO1 P09471 1/20 0.54
GNAI1 P63096 1/20 0.54
NOD1 Q9Y239 5/20 0.53
DPP7 Q9UHL4 2/20 0.53
SLC1A2 P43004 2/20 0.53
SLC1A1 P43005 2/20 0.53
RRM1 P23921 1/20 0.49
GSR P00390 1/20 0.48
GPR84 Q9NQS5 3/20 0.47
FFAR1 O14842 1/20 0.47
DDAH1 O94760 1/20 0.46
ANPEP P15144 1/20 0.46
ERAP2 Q6P179 1/20 0.46
NOS2 P35228 1/20 0.46
SLC1A3 P43003 1/20 0.46

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
SCHEMBL27608418 1.00 GRIK1 (0.56) GRIK1GRIK2GNAI3GNAO1GNAI1
SCHEMBL4385896 0.98 GRIK1 (0.57) GRIK1GRIK2GNAI3GNAO1GNAI1
SCHEMBL10615527 0.98 GRIK1 (0.57) GRIK1GRIK2GNAI3GNAO1GNAI1
SCHEMBL460141 0.96 GRIK1 (0.56) GRIK1GRIK2GNAI3GNAO1GNAI1
SCHEMBL9362560 0.96 GRIK1 (0.56) GRIK1GRIK2GNAI3GNAO1GNAI1
SCHEMBL25635471 0.95 NOD1 (0.55) GRIK1GRIK2GNAI3GNAO1GNAI1
SCHEMBL10286387 0.93 NOD1 (0.52) GRIK1GRIK2GNAI3GNAO1GNAI1
SCHEMBL10285774 0.93 NOD1 (0.52) GRIK1GRIK2GNAI3GNAO1GNAI1
SCHEMBL22777682 0.91 GRIK1 (0.53) GRIK1GRIK2GNAI3GNAO1GNAI1
SCHEMBL25227671 0.89 GSR (0.52) GRIK1GRIK2GNAI3GNAO1GNAI1

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
CN-104607097-B A kind of phase transfer catalysis prepares oils and fats acyl L-Lysine sodium salt and the method for the compositions comprising this surfactant 北京工商大学 2016-08-31 CN claimed
CN-104607097-B A kind of phase transfer catalysis prepares oils and fats acyl L-Lysine sodium salt and the method for the compositions comprising this surfactant 北京工商大学 2016-08-31 CN disclosed
CN-104955472-A Fatty acid acylated amino acids for growth hormone delivery NOVO NORDISK HEALTHCARE AG 2015-09-30 CN disclosed