Arginine

Arginine

SCHEMBL15324404

CC(C)C[C@H](N)C(=O)[O-].CC(C)C[C@H](N)C(=O)[O-].CC(N)=O.C[N+](C)(C)CCO.C[N+](C)(C)CCO.C[N+](C)(C)CCO.N=C(N)NCCC[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.N=C(N)NCCC[C@H](N)C(=O)[O-]

nearest known ligand 0.35

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 16)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 11/20 0.35
▸ NPY1R P25929 6/20 0.35
▸ NPY2R P49146 4/20 0.35
▸ NPY5R Q15761 4/20 0.35
▸ SLC7A5 Q01650 1/20 0.34
▸ OTC P00480 1/20 0.34
▸ ANPEP P15144 2/20 0.33
▸ RNPEP Q9H4A4 2/20 0.33
▸ DNPEP Q9ULA0 1/20 0.33
▸ NOS3 P29474 2/20 0.33
▸ NOS1 P29475 2/20 0.33
▸ NOS2 P35228 2/20 0.33
▸ DDAH1 O94760 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ KMT2A Q03164 1/20 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 SCHEMBL15323071 0.99 NPY4R (0.35) NPY4RNPY1RNPY2RNPY5RSLC7A5
Arginine SCHEMBL15323542 0.94 NPY4R (0.33) NPY4RNPY1RNPY2RNPY5RSLC7A5
Arginine SCHEMBL15324119 0.94 NPY4R (0.38) NPY4RNPY1RNPY2RNPY5RANPEP
Arginine SCHEMBL15324401 0.93 SLC7A5 (0.41) NPY4RNPY1RNPY2RNPY5RSLC7A5
Arginine SCHEMBL15323068 0.93 SLC7A5 (0.41) NPY4RNPY1RNPY2RNPY5RSLC7A5
Arginine SCHEMBL15322645 0.92 NPY4R (0.34) NPY4RNPY1RNPY2RNPY5RSLC7A5
Arginine SCHEMBL15324118 0.90 SLC7A5 (0.43) NPY4RNPY1RNPY2RNPY5RSLC7A5
Arginine SCHEMBL15322938 0.90 OTC (0.35) OTCNOS3NOS1NOS2DDAH1
Arginine SCHEMBL15323696 0.89 NPY4R (0.33) NPY4RNPY1RNPY2RNPY5RSLC7A5
Arginine SCHEMBL15322679 0.88 OTC (0.39) NPY4RNPY1RNPY2RNPY5ROTC

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-2836833-A1 PRENATAL SCREENING FOR DOWN SYNDROME AND TRISOMY 18 Wayne State University (US) 2015-02-18 — — EP disclosed
WO-2013155456-A1 PRENATAL SCREENING FOR DOWN SYNDROME AND TRISOMY 18 WAYNE STATE UNIVERSITY (US) 2013-10-17 — — WO disclosed
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