Arginine

Arginine

SCHEMBL15322388

C[N+](C)(C)CCO.N=C(N)NCCC[C@H](N)C(=O)O.NCC(=O)[O-].OCC(O)CO

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 10)

geneUniProtsupporting neighboursconfidence
▸ OTC P00480 1/20 0.35
▸ NOS1 P29475 4/20 0.34
▸ NOS3 P29474 3/20 0.34
▸ NOS2 P35228 3/20 0.34
▸ DDAH1 O94760 1/20 0.34
▸ GSR P00390 1/20 0.31
▸ SLC22A16 Q86VW1 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30
▸ KMT2A Q03164 1/20 0.30

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 SCHEMBL15324001 0.98 OTC (0.34) OTCNOS1NOS3NOS2DDAH1
Arginine SCHEMBL15322386 0.94 OTC (0.36) OTCNOS1NOS3NOS2DDAH1
Arginine SCHEMBL15323940 0.93 OTC (0.39) OTCNOS1NOS3NOS2DDAH1
Arginine SCHEMBL15323696 0.92 NPY4R (0.33) OTCDDAH1
Arginine SCHEMBL15322625 0.92 OTC (0.37) OTCNOS1NOS3NOS2DDAH1
Arginine SCHEMBL15323425 0.92 OTC (0.35) OTCNOS1NOS3NOS2DDAH1
Arginine SCHEMBL15324000 0.92 OTC (0.35) OTCNOS1NOS3NOS2DDAH1
Arginine SCHEMBL15323776 0.91 OTC (0.38) OTCNOS1NOS3NOS2DDAH1
Arginine SCHEMBL15323045 0.91 OTC (0.38) OTCNOS1NOS3NOS2DDAH1
Arginine SCHEMBL15322437 0.91 OTC (0.38) OTCNOS1NOS3NOS2DDAH1

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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