Glycine

Glycine

SCHEMBL6884146

NCC(=O)O.O=C1C=CC(CCCC(=O)O)C=C1

nearest known ligand 0.39

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
PTGS1 P23219 4/20 0.39
PTGS2 P35354 4/20 0.39
LMNA P02545 3/20 0.38
THRB P10828 2/20 0.38
BLM P54132 2/20 0.38
KMT2A Q03164 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
GABRR3 A8MPY1 1/20 0.38
GABRP O00591 1/20 0.38
GABRD O14764 1/20 0.38
HDAC3 O15379 1/20 0.38
GABBR2 O75899 1/20 0.38
CYP1A2 P05177 1/20 0.38
GABRA1 P14867 1/20 0.38
TSHR P16473 1/20 0.38
GABRB1 P18505 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRR1 P24046 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRR2 P28476 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
SCHEMBL6883452 0.93 PTGS1 (0.43) PTGS1PTGS2LMNAHDAC3TSHR
Benzoquinone SCHEMBL10412922 0.72 GLRA1 (0.59) PTGS1PTGS2LMNATHRBBLM
Adipic Acid SCHEMBL15658059 0.67 LMNA (0.73) LMNATHRBBLMKMT2ANPSR1
Benzoquinone SCHEMBL27728283 0.66 BLM (0.46) PTGS1PTGS2LMNATHRBBLM
Azelaic Acid SCHEMBL28076544 0.65 TSHR (0.75) LMNATHRBBLMKMT2ANPSR1
Glycine SCHEMBL28855970 0.65 TSHR (0.75) LMNATHRBBLMKMT2ANPSR1
Azelaic Acid SCHEMBL28549989 0.65 TSHR (0.75) LMNATHRBBLMKMT2ANPSR1
Succinic Acid SCHEMBL7413466 0.65 LMNA (0.56) PTGS1PTGS2LMNABLMKMT2A
Adipic Acid SCHEMBL541841 0.63 NFKB1 (0.65) LMNATHRBBLMKMT2ANPSR1
Gamma-Aminobutyric Acid SCHEMBL297249 0.63 LMNA (0.88) LMNATHRBBLMKMT2ANPSR1

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
WO-2004087933-A2 A NOVEL ENCODING METHOD FOR 'ONE-BEAD ONE-COMPOUND' COMBINATORIAL LIBRARIES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2004-10-14 WO disclosed