Arginine

Arginine

SCHEMBL8510534

CSCC[C@H](N)C(=O)OC(=O)[C@H](C)N.C[C@@H](O)[C@H](N)C(=O)O.N=C(N)NCCC[C@H](N)C(=O)O.N[C@@H](Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.32

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
CTSL P07711 3/20 0.31
CTSS P25774 3/20 0.31
CTSK P43235 3/20 0.31
CTSH P09668 1/20 0.31
FNTA P49354 10/20 0.31
FNTB P49356 10/20 0.31
PGGT1B P53609 10/20 0.31
APLNR P35414 1/20 0.31
NPY1R P25929 1/20 0.30
NPY4R P50391 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 SCHEMBL285822 0.93 FNTA (0.35) CTSLCTSSCTSKCTSHFNTA
Arginine SCHEMBL8512347 0.88 FNTA (0.37) CTSLCTSSCTSKCTSHFNTA
Arginine SCHEMBL23362144 0.88 FNTA (0.37) CTSLCTSSCTSKCTSHFNTA
Histidine SCHEMBL285813 0.87 GSR (0.33)
Arginine SCHEMBL2720905 0.85 NPY1R (0.31) NPY1RNPY4R
SCHEMBL17363643 0.84 FNTA (0.39) CTSLCTSSCTSKCTSHFNTA
Threonine SCHEMBL1964086 0.83 FNTA (0.35) FNTAFNTBPGGT1BNPY1RNPY4R
Leucine SCHEMBL10439243 0.82 APLNR (0.32) APLNR
Histidine SCHEMBL5502744 0.81 NPY4R (0.31) APLNRNPY1RNPY4R
Arginine SCHEMBL27607779 0.81 APLNR (0.36) CTSLCTSSCTSKCTSHFNTA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120135931-A1 METHOD OF MODIFYING SERINE PROTEASE INHIBITORS NATURAL ENVIRONMENT RESEARCH COUNCIL (GB) 2012-05-31 US disclosed