SCHEMBL1965668

SCHEMBL1965668

C[C@@H](OC(=O)[C@@H](N)CCCNC(=N)N)[C@H](N)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPY4R P50391 11/20 0.38
NPY1R P25929 6/20 0.38
OTC P00480 1/20 0.37
NOS3 P29474 2/20 0.35
NOS1 P29475 2/20 0.35
NOS2 P35228 2/20 0.35
NPY2R P49146 4/20 0.35
NPY5R Q15761 4/20 0.35
DDAH1 O94760 2/20 0.35
DPP7 Q9UHL4 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
GAA P10253 1/20 0.33
CYP2C19 P33261 1/20 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
Arginine SCHEMBL904454 0.97 OTC (0.41) NPY4RNPY1ROTCNOS3NOS1
SCHEMBL7142819 0.92 NPY4R (0.34) NPY4RNPY1ROTCNOS3NOS1
Arginine SCHEMBL6130138 0.92 GSR (0.46) NPY4RNPY1ROTCNOS3NOS1
SCHEMBL2125107 0.91 NPY4R (0.39) NPY4RNPY1ROTCNPY2RNPY5R
Arginine SCHEMBL10876829 0.89 GSR (0.43) NPY4RNPY1ROTCNOS3NOS1
SCHEMBL6155572 0.86 NPY4R (0.39) NPY4RNPY1ROTCNOS3NOS1
Tyrosine SCHEMBL11101797 0.85 NPY4R (0.51) NPY4RNPY1RNPY2RNPY5R
Arginine SCHEMBL333332 0.85 OTC (0.39) NPY4RNPY1ROTCNOS3NOS1
SCHEMBL5635045 0.84 NPY4R (0.41) NPY4RNPY1ROTCNPY2RNPY5R
SCHEMBL7782787 0.84 NPY4R (0.41) NPY4RNPY1ROTCNPY2RNPY5R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011072264-A2 METHODS AND COMPOSITIONS FOR BIOMASS TREATMENT QTEROS, INC. (US) 2011-06-16 WO disclosed
EP-1589096-B1 Method for producing L-amino acid AJINOMOTO KK (JP) 2010-03-17 EP disclosed
EP-1016710-B1 Method for producing L-amino acids AJINOMOTO KK (JP) 2010-03-17 EP disclosed
EP-1580262-B1 Method for producing L-amino acid AJINOMOTO KK (JP) 2010-01-27 EP disclosed