Arginine

Arginine

SCHEMBL6565610

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

nearest known ligand 0.38

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 20)

geneUniProtsupporting neighboursconfidence
OTC P00480 1/20 0.38
PTGS1 P23219 2/20 0.37
SLC7A11 Q9UPY5 1/20 0.37
NOS2 P35228 5/20 0.36
NOS3 P29474 4/20 0.36
NOS1 P29475 4/20 0.36
DDAH1 O94760 1/20 0.36
CYP2C19 P33261 2/20 0.34
CYP1A2 P05177 2/20 0.34
TSHR P16473 2/20 0.34
GLA P06280 1/20 0.34
NFKB1 P19838 1/20 0.34
APEX1 P27695 1/20 0.34
BHMT Q93088 1/20 0.34
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
NPY4R P50391 3/20 0.32
NPY1R P25929 2/20 0.32
NPY2R P49146 2/20 0.32
NPY5R Q15761 2/20 0.32

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 SCHEMBL6565605 1.00 OTC (0.38) OTCPTGS1SLC7A11NOS2NOS3
Arginine SCHEMBL6437080 0.96 CYP1A2 (0.38) OTCPTGS1SLC7A11NOS2NOS3
Arginine SCHEMBL6437076 0.96 CYP1A2 (0.38) OTCPTGS1SLC7A11NOS2NOS3
Arginine SCHEMBL6433284 0.94 OTC (0.42) OTCNOS2NOS3NOS1DDAH1
Arginine SCHEMBL6433292 0.94 OTC (0.42) OTCNOS2NOS3NOS1DDAH1
Arginine SCHEMBL6567386 0.94 ALOX15 (0.39) OTCPTGS1SLC7A11NOS2NOS3
Arginine SCHEMBL9188925 0.92 PTGS1 (0.44) OTCPTGS1SLC7A11NOS2NOS3
Arginine SCHEMBL5078038 0.92 PTGS1 (0.44) OTCPTGS1SLC7A11NOS2NOS3
Arginine SCHEMBL9188915 0.92 PTGS1 (0.44) OTCPTGS1SLC7A11NOS2NOS3
Arginine SCHEMBL27620474 0.91 ALOX15 (0.36) OTCPTGS1SLC7A11NOS2NOS3

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-1399147-A2 THERAPEUTIC DELIVERY OF CARBON MONOXIDE Northwick Park Institute For Medical Research (GB) 2004-03-24 EP claimed
WO-2002092075-A2 THERAPEUTIC DELIVERY OF CARBON MONOXIDE NORTHWICK PARK INSTITUTE FOR MEDICAL RESEARCH (GB) 2002-11-21 WO claimed