Arginine

Arginine

SCHEMBL28975305

N=C(N)NCCCC(N)C(=O)O.O=C(O)CC(=O)C(=O)O

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACES1PR1S1PR4S1PR5

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 0.47
▸ DDAH1 O94760 3/20 0.44
▸ NOS2 P35228 5/20 0.42
▸ NOS1 P29475 5/20 0.42
▸ NOS3 P29474 4/20 0.42
▸ GSR P00390 2/20 0.40
▸ CYP1A2 P05177 2/20 0.39
▸ CYP2C19 P33261 2/20 0.39
▸ GLA P06280 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ NFKB1 P19838 1/20 0.39
▸ APEX1 P27695 1/20 0.39
▸ GRM8 O00222 1/20 0.38
▸ GRM6 O15303 1/20 0.38
▸ GRIN2D O15399 1/20 0.38
▸ GRIN3B O60391 1/20 0.38
▸ GRIK1 P39086 1/20 0.38
▸ GRM5 P41594 1/20 0.38
▸ GRIA1 P42261 1/20 0.38
▸ GRIA2 P42262 1/20 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 SCHEMBL27680533 0.91 OTC (0.51) OTCDDAH1NOS2NOS1NOS3
Arginine SCHEMBL422530 0.91 OTC (0.54) OTCDDAH1NOS2NOS1NOS3
Arginine SCHEMBL422529 0.91 OTC (0.54) OTCDDAH1NOS2NOS1NOS3
Arginine SCHEMBL29050238 0.89 OTC (0.53) OTCDDAH1NOS2NOS1NOS3
Arginine SCHEMBL19816043 0.89 OTC (0.53) OTCDDAH1NOS2NOS1NOS3
Arginine SCHEMBL23608085 0.89 OTC (0.53) OTCDDAH1NOS2NOS1NOS3
Arginine SCHEMBL29050239 0.89 OTC (0.53) OTCDDAH1NOS2NOS1NOS3
Arginine SCHEMBL8678605 0.89 OTC (0.53) OTCDDAH1NOS2NOS1NOS3
Arginine SCHEMBL19816040 0.89 OTC (0.53) OTCDDAH1NOS2NOS1NOS3
Arginine SCHEMBL16194085 0.89 OTC (0.53) OTCDDAH1NOS2NOS1NOS3

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
CN-111249265-B Application of alpha-ketone short-chain dicarboxylic acid substances in improving reproductive capacity of animals 华南农业大学 2023-03-31 — — CN disclosed
Send feedback