Glycine

Glycine

SCHEMBL10470638

Cc1ccc(C(N)=O)c([N+](=O)[O-])c1OCc1ccccc1.NCC(=O)O

nearest known ligand 0.48

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
▸ PTPN1 P18031 1/20 0.41
▸ PTGER4 P35408 2/20 0.41
▸ PTGER3 P43115 2/20 0.41
▸ PTGER2 P43116 2/20 0.41
▸ PTGER1 P34995 1/20 0.41
▸ MGMT P16455 1/20 0.40
▸ MAPT P10636 2/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ POLB P06746 2/20 0.39
▸ CYP2C9 P11712 2/20 0.39
▸ CYP2C19 P33261 2/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ PARP10 Q53GL7 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ HTT P42858 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
SCHEMBL10473218 0.91 MEN1 (0.40) PTPN1PTGER4PTGER3PTGER2PTGER1
SCHEMBL12253970 0.87 PTPN1 (0.47) PTPN1PTGER4PTGER3PTGER2PTGER1
SCHEMBL12253971 0.82 ALDH1A1 (0.46) PTPN1MAPTKMT2AALDH1A1POLB
SCHEMBL14228268 0.80 MGMT (0.48) PTPN1PTGER4PTGER3PTGER2PTGER1
SCHEMBL10470640 0.79 LTA4H (0.48) PTPN1MGMTMAPTSMN1; SMN2MEN1
SCHEMBL14450789 0.76 HPGD (0.47) MAPTSMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL14199914 0.76 HPGD (0.47) MAPTSMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL15679923 0.76 MAPT (0.41) MAPTSMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL14199913 0.75 MEN1 (0.53) MAPTSMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL14199912 0.75 HPGD (0.46) MAPTSMN1; SMN2MEN1KMT2AALDH1A1

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-4942227-A ANTITUMOR AGENTS CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 1990-07-17 — — US disclosed
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