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Compound Detail

CHEMBL792

URIC ACID
🧪 Phase II
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🧪 Phase II
Oc1nc(O)c2nc(O)[nH]c2n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL792
Name URIC ACID
Phase Phase II
Structure Type MOL
InChI Key LEHOTFFKMJEONL-UHFFFAOYSA-N

Known Names

2,6,8-trioxypurine Idelalisib metabolite m54 Lithic acid NSC-3975 Uric acid Uricum acidum
2
Targets
10
Activities
3
Assay Types
0
PK Parameters
20
Publications
6
Known Names
1
Indications

Molecular Properties

168.1
MW (Da)
-0.53
ALogP
6
HBA
4
HBD
115.2
PSA (Ų)
0.42
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Achiral

Flags

Natural Product

Extended Properties

Molecular Formula C5H4N4O3
MW 168.11
Aromatic Rings 2
Heavy Atoms 12
NP-Likeness -0.57

Indications

Ischemic Stroke

Activity Summary

IC50 7 meas. best 4.22
Ki 2 meas. best 5.36
EC50 1 meas.

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Guanine deaminase
CHEMBL3129
 Ki 5.36 5.36 4340.0 1
Unchecked
CHEMBL612545
 IC50 4.22 3.7525 60000.0 4

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Guanine deaminase Ki = 4340.0 nM 5.36 Inhibition of GDA by colorimetric assay 20716488
Unchecked IC50 = 60000.0 nM 4.22 Inhibition of Escherichia coli recombinant N-terminal hexahistidine-tagged CTP s... 20004571
Unchecked IC50 = 96000.0 nM 4.02 Inhibition of Escherichia coli recombinant N-terminal hexahistidine-tagged CTP s... 20004571
Unchecked IC50 = 100000.0 nM 4.0 Inhibition of N-terminal His6-tagged Trypanosoma brucei CTPS assessed as NH3-dep... 21840216
Unchecked IC50 = 1700000.0 nM 2.77 Inhibition of Mycobacterium tuberculosis Uracil-DNA glycosylase using 5' 32P end... 37399710

Literature References

PubMed DOI Target Context # Activities
24507926 10.1016/j.bmcl.2014.01.045 NON-PROTEIN TARGET 10
15686937 10.1016/j.bmcl.2004.12.003 Rattus norvegicus 5
20004571 10.1016/j.bmcl.2009.11.017 Unchecked 4
28415050 10.1016/j.ejmech.2017.03.061 No relevant target 4
8496914 10.1021/jm00062a020 Unchecked 3
24507926 10.1016/j.bmcl.2014.01.045 No relevant target 2
37399710 10.1016/j.ejmech.2023.115604 Unchecked 2
10049739 10.1006/bbrc.1998.9978 Solute carrier family 22 member 6 2
18819812 10.1016/j.bmc.2008.09.024 NON-PROTEIN TARGET 2
- 10.6019/CHEMBL4495565 SARS-CoV-2 2
- 10.6019/CHEMBL4808148 Histone deacetylase 6 2
14586168 10.1159/000074539 Organic anion transporter 3 2
- 10.5281/zenodo.7360607 Solute carrier family 2, facilitated glucose transporter member 9 2
20965617 10.1016/j.ejmech.2010.09.055 Unchecked 1
12472777 10.1046/j.1523-1755.2003.00710.x Solute carrier family 22 member 6 1
9228014 10.1074/jbc.272.30.18526 Solute carrier family 22 member 6 1
21840216 10.1016/j.bmcl.2011.07.054 Unchecked 1
18314329 10.1016/j.bmcl.2008.02.038 Plasma 1
18314329 10.1016/j.bmcl.2008.02.038 NON-PROTEIN TARGET 1
8496914 10.1021/jm00062a020 Bos taurus 1

Data from ChEMBL 36 via Core Engine