Arginine

Arginine

SCHEMBL6681422

CCOC(Cc1cccc(NCc2ccc(OCCCN3CCOc4ccccc43)cc2)c1)C(=O)O.N=C(N)NCCC[C@H](N)C(=O)O

nearest known ligand 0.48

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 4)

geneUniProtsupporting neighboursconfidence
PPARG P37231 19/20 0.48
PPARA Q07869 17/20 0.48
PPARD Q03181 2/20 0.37
CACNA1B Q00975 1/20 0.36

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 SCHEMBL4867119 0.94 PPARG (0.52) PPARGPPARAPPARD
Arginine SCHEMBL4867150 0.94 PPARG (0.52) PPARGPPARAPPARD
Arginine SCHEMBL4822377 0.92 PPARG (0.50) PPARGPPARAPPARD
Arginine SCHEMBL4822370 0.92 PPARG (0.50) PPARGPPARAPPARD
Arginine SCHEMBL4824934 0.91 PPARG (0.40) PPARGPPARA
Arginine SCHEMBL4824931 0.91 PPARG (0.40) PPARGPPARA
SCHEMBL1860065 0.89 PPARG (0.59) PPARGPPARAPPARDCACNA1B
SCHEMBL4867157 0.86 PPARG (0.45) PPARGPPARAPPARD
Arginine SCHEMBL4826319 0.85 PPARG (0.44) PPARGPPARAPPARDCACNA1B
Arginine SCHEMBL4826312 0.85 PPARG (0.44) PPARGPPARAPPARDCACNA1B

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-1436268-A1 BENZOXAZINE AND BENZOTHIAZINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Dr. Reddy's Laboratories Ltd. (IN) 2004-07-14 EP disclosed
WO-2003033481-A1 BENZOXAZINE AND BENZOTHIAZINE DERIVATIVES AND PARMACEUTICAL COMPOSITIONS CONTAINING THEM DR. REDDY'S LABORATORIES LTD. (IN) 2003-04-24 WO disclosed