Glycine

Glycine

SCHEMBL11344722

CCc1cc(C)cc(C)c1N[C@@H](C)C(=O)OCCN(C)C.NCC(=O)O

nearest known ligand 0.37

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
ALDH1A1 P00352 6/20 0.37
KDM4E B2RXH2 4/20 0.37
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
TDP1 Q9NUW8 2/20 0.34
CHRM1 P11229 2/20 0.33
NLRP3 Q96P20 1/20 0.33
HTT P42858 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
PHLPP2 Q6ZVD8 1/20 0.32
CHRM2 P08172 1/20 0.31
CHRM3 P20309 1/20 0.31
CYP1A2 P05177 1/20 0.31
ADRA2A P08913 1/20 0.31
CYP2D6 P10635 1/20 0.31
PKM P14618 1/20 0.31
ADRA2B P18089 1/20 0.31
ADRA2C P18825 1/20 0.31
ADRA1D P25100 1/20 0.31
HTR2C P28335 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 SCHEMBL11341625 0.94 KDM4E (0.36) ALDH1A1KDM4ELMNASMN1; SMN2TDP1
Glycine SCHEMBL11341473 0.92 ALDH1A1 (0.41) ALDH1A1KDM4ELMNASMN1; SMN2TDP1
Glycine SCHEMBL11342339 0.87 LMNA (0.41) ALDH1A1LMNASMN1; SMN2NLRP3HTT
Glycine SCHEMBL11345153 0.87 LMNA (0.37) ALDH1A1LMNASMN1; SMN2NLRP3HTT
Glycine SCHEMBL11340461 0.85 LMNA (0.41) ALDH1A1LMNASMN1; SMN2NLRP3HTT
Glycine SCHEMBL11340541 0.85 PTGS2 (0.40) ALDH1A1KDM4ELMNASMN1; SMN2CHRM1
Glycine SCHEMBL11351199 0.85 LMNA (0.36) ALDH1A1LMNANLRP3HTT
Glycine SCHEMBL11350462 0.84 LMNA (0.35) ALDH1A1LMNASMN1; SMN2NLRP3HTT
Glycine SCHEMBL11347545 0.82 ALDH1A1 (0.42) ALDH1A1KDM4ELMNASMN1; SMN2TDP1
Glycine SCHEMBL11343414 0.81 LMNA (0.36) LMNANLRP3

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
US-4248886-A Combating fungi with N-oxalyl-N-phenyl-aminoacids and esters thereof BAYER AKTIENGESELLSCHAFT (DE) 1981-02-03 US disclosed