Glycine

Glycine

SCHEMBL6237182

NCC(=O)[O-].NCC(=O)[O-].O=C([O-])[O-].O=C([O-])[O-].[Mg+2].[Mg+2].[Mg+2]

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADORA1ADORA2AADORA2BADORA3PDE3APDE3BPDE4APDE4BPDE4CPDE4D

The experimentally established mechanism targets of Glycine. 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
CA4 P22748 4/20 0.44
GLRA1 P23415 1/20 0.44
SLC6A9 P48067 1/20 0.44
OR51E2 Q9H255 1/20 0.44
CASP1 P29466 1/20 0.39
FFAR3 O14843 2/20 0.35
HDAC3 O15379 2/20 0.35
HDAC1 Q13547 2/20 0.35
HDAC2 Q92769 2/20 0.35
HDAC8 Q9BY41 2/20 0.35
MEN1 O00255 1/20 0.33
LDHA P00338 1/20 0.33
BLM P54132 1/20 0.33
KMT2A Q03164 1/20 0.33
CA1 P00915 3/20 0.32
CA2 P00918 2/20 0.32
CA12 O43570 1/20 0.32
CA9 Q16790 1/20 0.32
GABRR1 P24046 1/20 0.32
FAHD1 Q6P587 1/20 0.31

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
Glycine SCHEMBL33936 0.96 CA4 (0.47) CA4GLRA1SLC6A9OR51E2CASP1
Glycine SCHEMBL16601 0.92 CA4 (0.50) CA4GLRA1SLC6A9OR51E2CASP1
Glycine SCHEMBL6237271 0.92 CA4 (0.44) CA4GLRA1SLC6A9OR51E2CASP1
Glycine SCHEMBL15845334 0.92 CA4 (0.44) CA4GLRA1SLC6A9OR51E2CASP1
Glycine SCHEMBL15842973 0.92 CA4 (0.44) CA4GLRA1SLC6A9OR51E2CASP1
Glycine SCHEMBL2586655 0.92 CA4 (0.44) CA4GLRA1SLC6A9OR51E2CASP1
Glycine SCHEMBL583139 0.92 CA4 (0.44) CA4GLRA1SLC6A9OR51E2CASP1
Glycine SCHEMBL142870 0.92 CA4 (0.44) CA4GLRA1SLC6A9OR51E2CASP1
Glycine SCHEMBL2916896 0.92 CA4 (0.50) CA4GLRA1SLC6A9OR51E2CASP1
Glycine SCHEMBL11272877 0.89 CA4 (0.41) CA4GLRA1SLC6A9OR51E2CASP1

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-2005011737-A2 PHARMACEUTICAL COMBINATIONS AND FORMULATIONS WITH IMPROVED STABILITY CIPLA LIMITED (IN) 2005-02-10 WO claimed
WO-2005011737-A2 PHARMACEUTICAL COMBINATIONS AND FORMULATIONS WITH IMPROVED STABILITY CIPLA LIMITED (IN) 2005-02-10 WO disclosed