Glycine

Glycine

SCHEMBL6684282

C=CCNC(=O)OC(C)(C)C.NCC(=O)O

nearest known ligand 0.41

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
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
PTPN11 Q06124 1/20 0.36
MAPT P10636 2/20 0.35
TSHR P16473 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA7 P43166 1/20 0.34
CA14 Q9ULX7 1/20 0.34
CTSS P25774 2/20 0.34
CTSK P43235 2/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
EPHX1 P07099 1/20 0.34
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL262291 0.89 TDP1 (0.47) KMT2AMEN1GAATDP1MAOA
Glycine SCHEMBL5171360 0.79 MEN1 (0.37) KMT2AMEN1GAATDP1MAOA
SCHEMBL6690077 0.78 SYK (0.50) KMT2AMEN1MAPTCA12CA1
SCHEMBL24503819 0.77 TDP1 (0.40) KMT2AMEN1GAATDP1MAOA
SCHEMBL9300578 0.75 TSHR (0.39) KMT2AMEN1GAATDP1MAPT
SCHEMBL4893443 0.75 TDP1 (0.49) KMT2AMEN1GAATDP1MAOA
SCHEMBL8775013 0.74 TDP1 (0.47) KMT2AMEN1GAATDP1MAOA
SCHEMBL2404127 0.74 TDP1 (0.50) KMT2AMEN1GAATDP1MAOA
SCHEMBL18487257 0.74 TDP1 (0.50) KMT2AMEN1GAATDP1MAOA
SCHEMBL18262007 0.74 TDP1 (0.50) KMT2AMEN1GAATDP1MAOA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004074316-A1 CONFORMATIONALLY CONSTRAINED BACKBONE CYCLIZED PEPTIDE ANALOGS GILON CHAIM (IL) 2004-09-02 WO claimed
WO-2004074316-A1 CONFORMATIONALLY CONSTRAINED BACKBONE CYCLIZED PEPTIDE ANALOGS GILON CHAIM (IL) 2004-09-02 WO disclosed
EP-0804468-A1 CONFORMATIONALLY CONSTRAINED BACKBONE CYCLIZED PEPTIDE ANALOG PEPTOR LTD (IL) 1997-11-05 EP disclosed
WO-1995033765-A1 CONFORMATIONALLY CONSTRAINED BACKBONE CYCLIZED PEPTIDE ANALOG PEPTOR LTD. (IL) 1995-12-14 WO disclosed