Arginine

Arginine

SCHEMBL28548707

N=C(N)NCCCC(N)C(=O)O.NC(CS)C(=O)O.NCC(=O)O.NCCCCC(N)C(=O)O.NCCCCC(N)C(=O)O

nearest known ligand 0.51

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
GSR P00390 1/20 0.51
PTGS1 P23219 2/20 0.41
SLC7A11 Q9UPY5 1/20 0.41
OTC P00480 1/20 0.41
CPB2 Q96IY4 2/20 0.40
GNAI3 P08754 1/20 0.40
GNAO1 P09471 1/20 0.40
GNAI1 P63096 1/20 0.40
DDAH1 O94760 2/20 0.39
NOS2 P35228 4/20 0.37
CYP1A2 P05177 2/20 0.37
TSHR P16473 2/20 0.37
GLA P06280 1/20 0.37
NFKB1 P19838 1/20 0.37
APEX1 P27695 1/20 0.37
CYP2C19 P33261 1/20 0.37
NOS3 P29474 3/20 0.37
NOS1 P29475 3/20 0.37
RNPEP Q9H4A4 1/20 0.36
ARG1 P05089 3/20 0.35

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 SCHEMBL28242594 0.96 GSR (0.56) GSRPTGS1SLC7A11OTCCPB2
Arginine SCHEMBL28527646 0.96 GSR (0.56) GSRPTGS1SLC7A11OTCCPB2
Arginine SCHEMBL27757865 0.95 GSR (0.47) GSRPTGS1SLC7A11OTCCPB2
Arginine SCHEMBL16637167 0.95 PTGS1 (0.46) GSRPTGS1SLC7A11OTCDDAH1
Arginine SCHEMBL28213703 0.95 PTGS1 (0.46) GSRPTGS1SLC7A11OTCDDAH1
Arginine SCHEMBL20678167 0.95 PTGS1 (0.46) GSRPTGS1SLC7A11OTCDDAH1
Arginine SCHEMBL22207237 0.93 GSR (0.59) GSROTCGNAI3GNAO1GNAI1
Arginine SCHEMBL18149040 0.93 GSR (0.59) GSROTCGNAI3GNAO1GNAI1
Arginine SCHEMBL18149039 0.93 GSR (0.59) GSROTCGNAI3GNAO1GNAI1
Arginine SCHEMBL1696994 0.93 GSR (0.59) GSROTCGNAI3GNAO1GNAI1

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-109701040-B Nano PAMAM (polyamidoamine) targeted polypeptide radionuclide preparation for diagnosing and treating MTC (MTC) and preparation method thereof 昆明医科大学第一附属医院 2021-04-06 CN disclosed