Arginine

Arginine

SCHEMBL7443448

N=C(N)NCCC[C@H](N)C(=O)O.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

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 20)

geneUniProtsupporting neighboursconfidence
OTC P00480 1/20 0.48
DDAH1 O94760 3/20 0.45
NOS2 P35228 4/20 0.43
NOS3 P29474 3/20 0.43
NOS1 P29475 3/20 0.43
GSR P00390 1/20 0.41
CYP2C19 P33261 2/20 0.40
CYP1A2 P05177 1/20 0.40
GLA P06280 1/20 0.40
TSHR P16473 1/20 0.40
NFKB1 P19838 1/20 0.40
APEX1 P27695 1/20 0.40
NPY4R P50391 1/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
ALOX15 P16050 1/20 0.38
BLM P54132 1/20 0.38
PMP22 Q01453 1/20 0.38
S1PR1 P21453 4/20 0.38
S1PR3 Q99500 4/20 0.38

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 SCHEMBL7432633 1.00 OTC (0.48) OTCDDAH1NOS2NOS3NOS1
Arginine SCHEMBL29664038 1.00 OTC (0.48) OTCDDAH1NOS2NOS3NOS1
Trifluoroacetic Acid SCHEMBL31651399 0.91 NPY4R (0.40) OTCDDAH1NPY4RS1PR1S1PR3
Arginine SCHEMBL1790 0.90 OTC (0.56) OTCDDAH1NOS2NOS3NOS1
Arginine SCHEMBL6374054 0.90 OTC (0.56) OTCDDAH1NOS2NOS3NOS1
Arginine SCHEMBL288132 0.90 OTC (0.56) OTCDDAH1NOS2NOS3NOS1
Arginine SCHEMBL31663499 0.90 OTC (0.56) OTCDDAH1NOS2NOS3NOS1
Arginine SCHEMBL7928810 0.90 OTC (0.56) OTCDDAH1NOS2NOS3NOS1
Arginine SCHEMBL2411547 0.90 OTC (0.56) OTCDDAH1NOS2NOS3NOS1
Arginine SCHEMBL1791 0.90 OTC (0.56) OTCDDAH1NOS2NOS3NOS1

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
EP-0577775-A4 ANTI-THROMBOTIC PEPTIDES AND PSEUDOPEPTIDES. RHONE POULENC RORER INT (US) 1995-01-11 EP disclosed
EP-0577775-A1 ANTI-THROMBOTIC PEPTIDES AND PSEUDOPEPTIDES RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1994-01-12 EP disclosed
WO-1992017196-A1 ANTI-THROMBOTIC PEPTIDES AND PSEUDOPEPTIDES RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1992-10-15 WO disclosed