Arginine

Arginine

SCHEMBL4073128

COC(Cc1ccc(NCCCc2cccc(OS(C)(=O)=O)c2)cc1)C(=O)O.N=C(N)NCCC[C@H](N)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 10)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 3/20 0.38
MTNR1B P49286 3/20 0.38
PPARG P37231 5/20 0.36
PPARA Q07869 4/20 0.36
PPARD Q03181 2/20 0.35
FFAR1 O14842 1/20 0.35
NPY1R P25929 1/20 0.34
NPY4R P50391 1/20 0.34
FAAH O00519 1/20 0.34
KMT2A Q03164 1/20 0.33

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 SCHEMBL4073126 1.00 MTNR1A (0.38) MTNR1AMTNR1BPPARGPPARAPPARD
Arginine SCHEMBL4085067 1.00 MTNR1A (0.38) MTNR1AMTNR1BPPARGPPARAPPARD
Arginine SCHEMBL4073313 0.93 PPARG (0.44) MTNR1AMTNR1BPPARGPPARAPPARD
Arginine SCHEMBL4073310 0.93 PPARG (0.44) MTNR1AMTNR1BPPARGPPARAPPARD
SCHEMBL4085070 0.90 MTNR1A (0.39) MTNR1AMTNR1BNPY1RNPY4R
SCHEMBL4073129 0.90 MTNR1A (0.39) MTNR1AMTNR1BNPY1RNPY4R
SCHEMBL4073441 0.87 PPARG (0.45) MTNR1AMTNR1BPPARGPPARAPPARD
SCHEMBL4084583 0.87 PPARG (0.45) MTNR1AMTNR1BPPARGPPARAPPARD
Arginine SCHEMBL4073283 0.85 PPARA (0.53) PPARGPPARAPPARD
Arginine SCHEMBL4073279 0.85 PPARA (0.53) PPARGPPARAPPARD

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
US-7598293-B2 Compounds and their use in medicine, process for their preparation and pharmaceutical compositions containing them DR. REDDY'S LABORATORIES, INC. (US) 2009-10-06 US claimed
EP-1453795-A2 ESTERS AND AMIDES AS PPAR-ALPHA AGONISTS Dr. Reddy's Laboratories Ltd. (IN) 2004-09-08 EP disclosed
WO-2003048116-A2 ESTERS AND AMIDES AS PPAR-ALPHA AGONISTS ____________ DR. REDDY'S LABORATORIES LTD. (IN) 2003-06-12 WO disclosed