Glycine

Glycine

SCHEMBL28537104

CC(O)CC(=O)NC(C)C(=O)O.NCC(=O)O

nearest known ligand 0.45

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 17)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.39
ALDH1A1 P00352 3/20 0.38
MAPT P10636 1/20 0.38
GLRA1 P23415 1/20 0.37
SLC6A9 P48067 1/20 0.37
OR51E2 Q9H255 1/20 0.37
LTA4H P09960 3/20 0.36
KDM4E B2RXH2 2/20 0.36
MME P08473 3/20 0.36
ACE P12821 1/20 0.36
CPA1 P15085 1/20 0.36
ACE2 Q9BYF1 1/20 0.36
TSHR P16473 1/20 0.36
SLC6A5 Q9Y345 1/20 0.36
ANPEP P15144 1/20 0.34
ECE1 P42892 1/20 0.34

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
SCHEMBL1644160 0.90 FAAH (0.46) FAAHSMN1; SMN2ALDH1A1MAPTLTA4H
SCHEMBL1644161 0.90 FAAH (0.46) FAAHSMN1; SMN2ALDH1A1MAPTLTA4H
Valine SCHEMBL28546102 0.82 SLC7A5 (0.52) FAAHSMN1; SMN2ALDH1A1MAPTLTA4H
D-Glutamate SCHEMBL28535135 0.80 CYP1A2 (0.55) FAAH
SCHEMBL564562 0.80 SMN1; SMN2 (0.50) FAAHSMN1; SMN2ALDH1A1MAPTKDM4E
SCHEMBL3145911 0.80 SMN1; SMN2 (0.50) FAAHSMN1; SMN2ALDH1A1MAPTKDM4E
SCHEMBL783990 0.80 SMN1; SMN2 (0.50) FAAHSMN1; SMN2ALDH1A1MAPTKDM4E
Glycine SCHEMBL28551545 0.78 ALDH1A1 (0.50) ALDH1A1
Isoleucine SCHEMBL28534804 0.78 MME (0.45) FAAHSMN1; SMN2ALDH1A1MAPTKDM4E
Hydrochloric Acid SCHEMBL2487054 0.78 SMN1; SMN2 (0.49) FAAHSMN1; SMN2ALDH1A1MAPTKDM4E

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-108017555-B Beta-hydroxybutyryl-amino acid compound and preparation method and application thereof 郑州海斯威生物技术有限公司 2021-03-26 CN disclosed