Arginine

Arginine

SCHEMBL5544129

C[C@H](N)C(=O)O.N=C(N)NCCC[C@H](N)C(=O)O.N=C(N)NCCC[C@H](N)C(=O)O

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACE

The experimentally established mechanism targets of Arginine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
OTC P00480 1/20 0.50
NOS2 P35228 8/20 0.49
NOS1 P29475 8/20 0.49
NOS3 P29474 6/20 0.49
DDAH1 O94760 3/20 0.47
CYP2C19 P33261 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
GSR P00390 1/20 0.43
CYP1A2 P05177 2/20 0.42
TSHR P16473 2/20 0.42
CYP3A4 P08684 1/20 0.42
GLA P06280 1/20 0.42
NFKB1 P19838 1/20 0.42
APEX1 P27695 1/20 0.42
BLM P54132 1/20 0.41
NOD1 Q9Y239 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
Arginine SCHEMBL5544125 1.00 OTC (0.50) OTCNOS2NOS1NOS3DDAH1
Arginine SCHEMBL1675351 1.00 OTC (0.50) OTCNOS2NOS1NOS3DDAH1
Arginine SCHEMBL9754275 1.00 OTC (0.50) OTCNOS2NOS1NOS3DDAH1
Arginine SCHEMBL1821002 1.00 OTC (0.50) OTCNOS2NOS1NOS3DDAH1
Arginine SCHEMBL2787541 1.00 OTC (0.50) OTCNOS2NOS1NOS3DDAH1
Arginine SCHEMBL2397458 1.00 OTC (0.50) OTCNOS2NOS1NOS3DDAH1
Arginine SCHEMBL5312506 1.00 OTC (0.50) OTCNOS2NOS1NOS3DDAH1
Arginine SCHEMBL15323423 0.97 OTC (0.48) OTCNOS2NOS1NOS3DDAH1
Arginine SCHEMBL11018148 0.97 OTC (0.48) OTCNOS2NOS1NOS3DDAH1
Arginine SCHEMBL15323426 0.97 OTC (0.48) OTCNOS2NOS1NOS3DDAH1

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
EP-1490678-A4 COMPOSITIONS AND METHODS FOR MODELING BACILLUS SUBTILIS METABOLISM GENOMATICA INC (US) 2007-01-03 EP disclosed
EP-1490678-A2 COMPOSITIONS AND METHODS FOR MODELING BACILLUS SUBTILIS METABOLISM Genomatica, Inc. (US) 2004-12-29 EP disclosed
WO-2003081207-A2 COMPOSITIONS AND METHODS FOR MODELING BACILLUS SUBTILIS METABOLISM GENOMATICA, INC. (US) 2003-10-02 WO disclosed