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Compound Detail

CHEMBL773

GLYCINE
💊 Approved Drug
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💊 Approved Drug

Basic Information

ChEMBL ID CHEMBL773
Name GLYCINE
Phase Approved
Structure Type MOL
InChI Key DHMQDGOQFOQNFH-UHFFFAOYSA-N

Known Names

FEMA NO. 3287 Glicina Glycine Glycolixir NSC-25936
10
Targets
33
Activities
3
Assay Types
0
PK Parameters
20
Publications
5
Known Names
17
Indications

Molecular Properties

75.1
MW (Da)
-0.97
ALogP
2
HBA
2
HBD
63.3
PSA (Ų)
0.42
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
First Approval 1982
Availability Prescription
Chirality Achiral

Flags

Natural Product
USAN Stem -ium

Extended Properties

Molecular Formula C2H5NO2
MW 75.07
Aromatic Rings 0
Heavy Atoms 5
NP-Likeness 0.45

Indications

Diarrhea Malnutrition Schizophrenia Asthma Bipolar Disorder Cystic Fibrosis Herpes Labialis Herpes Simplex Hypertension Mental Disorders Obsessive-Compulsive Disorder Psychotic Disorders Respiratory Tract Diseases HIV Infections Alzheimer Disease Cognitive Dysfunction Severe Acute Respiratory Syndrome

ATC Classification

B05CX03
glycine
Level 1: BLOOD AND BLOOD FORMING ORGANS
Level 2: BLOOD SUBSTITUTES AND PERFUSION SOLUTIONS

Activity Summary

EC50 16 meas. best 7.24
IC50 13 meas. best 7.07
Ki 4 meas. best 6.9

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Olfactory receptor 51E2
CHEMBL4523454
EC50 7.24 7.24 58.0 1
Glutamate NMDA receptor
CHEMBL1907608
EC50 7.17 6.935 68.0 2
Glutamate NMDA receptor
CHEMBL1907608
IC50 7.07 6.6433 86.0 3
Ionotropic glutamate receptor NMDA 1/2D
CHEMBL3038506
EC50 7.04 7.04 91.0 1
Unchecked
CHEMBL612545
EC50 7.02 6.66 96.0 4
Glutamate NMDA receptor
CHEMBL1907608
Ki 6.9 6.835 125.9 2
Glutamate NMDA receptor; Grin1/Grin2c
CHEMBL2096911
EC50 6.68 6.68 210.0 1
Unchecked
CHEMBL612545
IC50 6.65 5.3675 223.0 4
Glutamate NMDA receptor; Grin1/Grin2b
CHEMBL2096666
EC50 6.62 6.62 240.0 1
Glutamate receptor ionotropic, NMDA 1
CHEMBL330
IC50 6.6 5.905 250.0 2
Glutamate NMDA receptor; Grin1/Grin2a
CHEMBL2096680
EC50 6.0 6.0 990.0 1
Sodium- and chloride-dependent glycine transporter 1
CHEMBL2337
IC50 4.5 4.5 31600.0 1
Glycine receptor subunit alpha-1
CHEMBL5845
EC50 4.03 4.025 94000.0 2

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Olfactory receptor 51E2 EC50 = 58.0 nM 7.24 Agonist activity at PSGR/OR51E2 (unknown origin) expressed in human Hana3A cells... -
Glutamate NMDA receptor EC50 = 68.0 nM 7.17 In vitro concentration eliciting half-maximal effect on [3H]-MK 801 radioligand ... 10360746
Glutamate NMDA receptor IC50 = 86.0 nM 7.07 Tested for binding affinity against NMDA receptor, from rat synaptic membrane, u... 8093907
Ionotropic glutamate receptor NMDA 1/2D EC50 = 91.0 nM 7.04 Agonist activity at rat GluN1/GluN2D NMDA receptor expressed in Xenopus oocytes ... 34918931
Unchecked EC50 = 96.0 nM 7.02 Effective concentration against NR1/NR2D receptor 10893301
Glutamate NMDA receptor Ki = 125.89 nM 6.9 Displacement of [3H]glycine from strychnine-insensitive glycine recognition site... 19642674
Unchecked EC50 = 150.0 nM 6.82 Effective concentration against NR1/NR2C receptor 10893301
Glutamate NMDA receptor Ki = 170.0 nM 6.77 Affinity for the glycine binding site of NMDA receptor by inhibition of [3H]5,7-... 7966156
Unchecked EC50 = 190.0 nM 6.72 Effective concentration against NR1/NR2B receptor 10893301
Glutamate NMDA receptor EC50 = 200.0 nM 6.7 Compound was evaluated for in vitro inhibition of [3H]TCP at NMDA receptor 7990104
Glutamate NMDA receptor IC50 = 200.0 nM 6.7 In vitro inhibition of [3H]glycine at NMDA receptor 7990104
Glutamate NMDA receptor; Grin1/Grin2c EC50 = 210.0 nM 6.68 Agonist activity at rat GluN1/GluN2C NMDA receptor expressed in Xenopus oocytes ... 34918931
Unchecked IC50 = 223.0 nM 6.65 Inhibition of rat glutamate receptor 20875743
Glutamate NMDA receptor; Grin1/Grin2b EC50 = 240.0 nM 6.62 Agonist activity at rat GluN1/GluN2B NMDA receptor expressed in Xenopus oocytes ... 34918931
Glutamate receptor ionotropic, NMDA 1 IC50 = 250.0 nM 6.6 In vitro inhibitory activity to inhibit [3H]glycine binding to NMDA receptor 10360746
Glutamate NMDA receptor IC50 = 690.0 nM 6.16 Binding affinity against glycine binding site associated with N-methyl-D-asparta... 1433216
Unchecked EC50 = 840.0 nM 6.08 Effective concentration against NR1/NR2A receptor 10893301
Glutamate NMDA receptor; Grin1/Grin2a EC50 = 990.0 nM 6.0 Agonist activity at rat GluN1/GluN2A NMDA receptor expressed in Xenopus oocytes ... 34918931
Unchecked IC50 = 6000.0 nM 5.22 Inhibition of binding of [3H]strychnine to glycine receptor in rat 2549245
Glutamate receptor ionotropic, NMDA 1 IC50 = 6200.0 nM 5.21 Inhibitory concentration required to inhibit [3H]strychnine binding to N-methyl-... 1310117

Literature References

PubMed DOI Target Context # Activities
- 10.6019/CHEMBL3885881 Rattus norvegicus 193
22194678 10.1371/journal.pcbi.1002310 Hepatotoxicity 14
9438018 10.1021/jm970086f Mus musculus 10
20833035 10.1016/j.bmcl.2009.05.077 Mus musculus 6
20014752 10.1021/tx900326k Hepatotoxicity 6
16759105 10.1021/jm0511029 Solute carrier family 15 member 1 4
10893301 10.1021/jm000007r Unchecked 4
27624080 10.1016/j.bmcl.2016.09.001 Large neutral amino acids transporter small subunit 1 3
37468498 10.1038/s41467-023-40064-9 Thromboxane A2 receptor 2
17722904 10.1021/jm070574f Glycine receptor subunit alpha-1 2
22931300 10.1021/tx300075j Cytochrome P450 3A4 2
21657271 10.1021/jm2001663 NON-PROTEIN TARGET 2
21940173 10.1016/j.bmc.2011.08.039 GABA transporter 4 2
11714598 10.1016/s0960-894x(01)00608-4 Hairpin ribozyme RNA 2
7990104 10.1021/jm00050a001 Glutamate NMDA receptor 2
- 10.6019/CHEMBL4651402 SARS-CoV-2 2
21955456 10.1016/j.bmc.2011.08.058 Proton-coupled amino acid transporter 1 2
30048132 10.1021/acs.jmedchem.8b01007 Large neutral amino acids transporter small subunit 1 2
37468498 10.1038/s41467-023-40064-9 Muscarinic acetylcholine receptor M1 2
- 10.6019/CHEMBL4495565 SARS-CoV-2 2

Data from ChEMBL 36 via Core Engine