Arginine

Arginine

SCHEMBL28410966

CNS(=O)(=O)c1ccccc1.N=C(N)NCCCC(N)C(=O)O

nearest known ligand 0.42

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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 19)

geneUniProtsupporting neighboursconfidence
▸ LARS1 Q9P2J5 1/20 0.41
▸ ITGB3 P05106 2/20 0.40
▸ ITGA2B P08514 2/20 0.40
▸ SLC1A3 P43003 2/20 0.39
▸ SLC1A2 P43004 2/20 0.39
▸ SLC1A1 P43005 2/20 0.39
▸ MMP2 P08253 4/20 0.39
▸ MMP9 P14780 4/20 0.39
▸ MMP8 P22894 3/20 0.39
▸ MMP12 P39900 3/20 0.39
▸ MMP14 P50281 3/20 0.39
▸ OTC P00480 1/20 0.39
▸ TDP1 Q9NUW8 2/20 0.38
▸ NOS3 P29474 1/20 0.37
▸ NOS1 P29475 1/20 0.37
▸ NOS2 P35228 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ DDAH1 O94760 1/20 0.37

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
SCHEMBL28409652 0.90 NPY4R (0.41) LARS1ITGB3ITGA2BTDP1POLB
Arginine SCHEMBL16552839 0.86 CASR (0.44) OTCTDP1POLBKMT2ADDAH1
Arginine SCHEMBL16553173 0.86 CASR (0.44) OTCTDP1POLBKMT2ADDAH1
Arginine SCHEMBL28968791 0.86 EPHX2 (0.42) OTC
Arginine SCHEMBL16879777 0.82 KIF11 (0.47) OTCTDP1NOS3NOS1NOS2
Arginine SCHEMBL28268971 0.82 OTC (0.53) OTCNOS3NOS1NOS2KMT2A
Arginine SCHEMBL26914670 0.81 KIF11 (0.46) OTCTDP1POLBKMT2ADDAH1
Arginine SCHEMBL17874428 0.80 PMP22 (0.50) OTCNOS3NOS1NOS2KMT2A
Arginine SCHEMBL6468370 0.80 PMP22 (0.50) OTCNOS3NOS1NOS2KMT2A
Arginine SCHEMBL17874429 0.80 PMP22 (0.50) OTCNOS3NOS1NOS2KMT2A

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
CN-111269206-A Synthetic method and application of arginine derivative Bz-Arg-AMC 重庆医药高等专科学校 2020-06-12 — — CN disclosed
CN-111233973-A Synthesis method and application of arginine derivative Pro-Phe-Arg-AMC 重庆医药高等专科学校 2020-06-05 — — CN disclosed
CN-111196838-A Synthesis method and application of arginine derivative Cbz-Phe-Arg-AMC 重庆医药高等专科学校 2020-05-26 — — CN disclosed
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