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Arginine

Arginine

SCHEMBL9702449

CC(C)[C@H](N)C(=O)O.CC[C@H](C)[C@H](N)C(=O)O.C[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.NC(=O)CC[C@H](N)C(=O)O.NCC(=O)O.NCC(=O)O.N[C@@H](Cc1ccccc1)C(=O)O.O=C(O)[C@@H]1CCCN1

nearest known ligand 0.37

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 13)

geneUniProtsupporting neighboursconfidence
▸ KEAP1 Q14145 1/20 0.37
▸ REN P00797 2/20 0.36
▸ MAPK8 P45983 1/20 0.36
▸ MAPK9 P45984 1/20 0.36
▸ MAPK10 P53779 1/20 0.36
▸ F12 P00748 3/20 0.33
▸ KDM1A O60341 3/20 0.33
▸ CTSC P53634 1/20 0.33
▸ MAOB P27338 1/20 0.33
▸ KDM5A P29375 1/20 0.33
▸ KDM1B Q8NB78 1/20 0.33
▸ VIPR2 P41587 6/20 0.32
▸ VIPR1 P32241 5/20 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 SCHEMBL7576309 0.95 REN (0.38) KEAP1RENMAPK8MAPK9MAPK10
Arginine SCHEMBL8619483 0.93 KDM1A (0.37) KEAP1F12KDM1AMAOBKDM5A
Arginine SCHEMBL8614042 0.93 KDM1A (0.37) KEAP1F12KDM1AMAOBKDM5A
Arginine SCHEMBL3251258 0.93 KDM1A (0.36) KEAP1RENMAPK8MAPK9MAPK10
Tyrosine SCHEMBL9705162 0.91 NPY4R (0.38) RENMAPK8MAPK9MAPK10CTSC
Arginine SCHEMBL11147102 0.91 CTSC (0.37) RENMAPK8MAPK9MAPK10KDM1A
Arginine SCHEMBL29169734 0.91 KEAP1 (0.40) KEAP1RENMAPK8MAPK9MAPK10
Arginine SCHEMBL25171512 0.89 PRCP (0.33) —
Arginine SCHEMBL28022079 0.88 REN (0.39) KEAP1RENMAPK8MAPK9MAPK10
Arginine SCHEMBL28199097 0.88 REN (0.39) KEAP1RENMAPK8MAPK9MAPK10

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
WO-1992014489-A1 POLIOVIRUS-BASED VACCINES REPLIGEN CORPORATION (US) 1992-09-03 — — WO claimed
WO-1992014489-A1 POLIOVIRUS-BASED VACCINES REPLIGEN CORPORATION (US) 1992-09-03 — — WO disclosed