SCHEMBL5783209

SCHEMBL5783209

CCCCCCCCCCCCCCCCCCN(C(N)=O)[C@@H](CCCCN)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.44
PPARD Q03181 1/20 0.44
ZDHHC20 Q5W0Z9 1/20 0.44
ZDHHC2 Q9UIJ5 1/20 0.44
GRIK1 P39086 2/20 0.42
GRIK2 Q13002 2/20 0.42
GNAI3 P08754 1/20 0.41
GNAO1 P09471 1/20 0.41
GNAI1 P63096 1/20 0.41
GPR84 Q9NQS5 3/20 0.41
FFAR1 O14842 1/20 0.41
SLC6A5 Q9Y345 1/20 0.40
CPB2 Q96IY4 2/20 0.40
MAPT P10636 1/20 0.40
SLC1A2 P43004 1/20 0.40
SLC1A1 P43005 1/20 0.40
GSR P00390 1/20 0.39
DNM1 Q05193 4/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL27768079 1.00 LCK (0.44) LCKPPARDZDHHC20ZDHHC2GRIK1
SCHEMBL19925187 0.98 LCK (0.41) LCKPPARDZDHHC20ZDHHC2GRIK1
SCHEMBL29067246 0.88 GRIK1 (0.41) LCKPPARDZDHHC20ZDHHC2GRIK1
SCHEMBL29832205 0.83 CPB2 (0.43) LCKPPARDZDHHC20ZDHHC2GRIK1
SCHEMBL20542960 0.83 GNAI3 (0.60) GNAI3GNAO1GNAI1SLC6A5EPHX1
SCHEMBL29832367 0.83 CPB2 (0.43) LCKPPARDZDHHC20ZDHHC2GRIK1
SCHEMBL1031164 0.83 NOD1 (0.51) LCKPPARDZDHHC20ZDHHC2GRIK1
SCHEMBL30775015 0.83 NOD1 (0.51) LCKPPARDZDHHC20ZDHHC2GRIK1
SCHEMBL341674 0.83 NOD1 (0.51) LCKPPARDZDHHC20ZDHHC2GRIK1
SCHEMBL28077042 0.83 NOD1 (0.51) LCKPPARDZDHHC20ZDHHC2GRIK1

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
EP-1676556-A2 Cosmetic composition containing a polyorganosiloxane polymer L'OREAL (FR) 2006-07-05 EP disclosed