SCHEMBL10928131

SCHEMBL10928131

CC(C)CC(N)C(=O)NCCCC[C@H](N)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 2/20 0.54
SLC7A5 Q01650 1/20 0.53
GNAI3 P08754 1/20 0.51
GNAO1 P09471 1/20 0.51
GNAI1 P63096 1/20 0.51
NOD1 Q9Y239 1/20 0.49
ANPEP P15144 3/20 0.49
RNPEP Q9H4A4 2/20 0.49
DNPEP Q9ULA0 2/20 0.49
RRM1 P23921 1/20 0.46
GSR P00390 1/20 0.46
OTC P00480 1/20 0.45
SLC1A3 P43003 1/20 0.43
SLC1A2 P43004 1/20 0.43
ARG1 P05089 3/20 0.42
ARG2 P78540 3/20 0.42
NOS3 P29474 1/20 0.41
NOS1 P29475 1/20 0.41
NOS2 P35228 1/20 0.41

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
SCHEMBL19992546 0.89 DPP7 (0.49) DPP7SLC7A5GNAI3GNAO1GNAI1
SCHEMBL1769033 0.88 SLC7A5 (0.59) DPP7SLC7A5NOD1ANPEPRNPEP
SCHEMBL1769031 0.88 SLC7A5 (0.59) DPP7SLC7A5NOD1ANPEPRNPEP
SCHEMBL1769602 0.88 SLC7A5 (0.59) DPP7SLC7A5NOD1ANPEPRNPEP
SCHEMBL1768387 0.88 SLC7A5 (0.59) DPP7SLC7A5NOD1ANPEPRNPEP
SCHEMBL20006611 0.85 DPP7 (0.54) DPP7GNAI3GNAO1GNAI1NOD1
SCHEMBL20085606 0.85 DPP7 (0.54) DPP7GNAI3GNAO1GNAI1NOD1
SCHEMBL17451629 0.85 DPP7 (0.54) DPP7GNAI3GNAO1GNAI1NOD1
SCHEMBL9113004 0.84 DPP7 (0.52) DPP7SLC7A5GNAI3GNAO1GNAI1
SCHEMBL19738538 0.83 DPP7 (0.53) DPP7GNAI3GNAO1GNAI1NOD1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0162877-A1 Method to titrate enzymes. FLORK MICHEL (FR) 1985-12-04 EP disclosed
WO-1985002404-A1 NEW PEPTIDE DERIVATIVES, PREPARATION PROCESS THEREOF AND UTILIZATION THEREOF AS BIOLOGICAL REAGENTS FLORK MICHEL 1985-06-06 WO disclosed