Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL284733

DICLAZURIL
🧪 Phase II
Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
🧪 Phase II
N#CC(c1ccc(Cl)cc1)c1c(Cl)cc(-n2ncc(=O)[nH]c2=O)cc1Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL284733
Name DICLAZURIL
Phase Phase II
Structure Type MOL
InChI Key ZSZFUDFOPOMEET-UHFFFAOYSA-N

Known Names

Clinacox Diclazuril Diclazuril for veterinary use Diclazurilo NSC-759642 Nuoqiu P-64433 R-64-433 R-64433 R64,433 Vecoxan
5
Targets
8
Activities
3
Assay Types
0
PK Parameters
18
Publications
11
Known Names

Molecular Properties

407.6
MW (Da)
3.54
ALogP
5
HBA
1
HBD
91.5
PSA (Ų)
0.72
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Racemic

Flags

Natural Product
USAN Year 1988

Extended Properties

Molecular Formula C17H9Cl3N4O2
MW 407.64
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -1.19

Activity Summary

EC50 6 meas. best 5.1
IC50 1 meas. best 8.22
Kd 1 meas.

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Toxoplasma gondii
CHEMBL612888
 IC50 8.22 8.22 6.0 1
Nuclear receptor subfamily 1 group I member 2
CHEMBL3401
 EC50 5.1 4.6833 7900.0 3
Nuclear receptor subfamily 1 group I member 2
CHEMBL2146315
 EC50 5.05 5.05 9000.0 1
NON-PROTEIN TARGET
CHEMBL3879801
 EC50 4.51 4.51 31000.0 1
Influenza A virus
CHEMBL613740
 EC50 4.51 4.51 31000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Toxoplasma gondii IC50 = 6.0 nM 8.22 Antiparasitic activity against Toxoplasma gondii tachyzoites 34894691
Nuclear receptor subfamily 1 group I member 2 EC50 = 7900.0 nM 5.1 Competitive binding affinity to human PXR LBD (111 to 434) by TR-FRET assay 20966043
Nuclear receptor subfamily 1 group I member 2 EC50 = 9000.0 nM 5.05 Activation of rat PXR expressed in human HepG2 cells after 24 hrs by luciferase ... 20966043
Influenza A virus EC50 = 31000.0 nM 4.51 Antiviral activity against Influenza A virus (A/PR/8/34) (H1N1) infected in MDCK... 25856229
NON-PROTEIN TARGET EC50 = 31000.0 nM 4.51 Antiviral activity against Influenza A virus A/PR/8/34 (H1N1) infected in MDCK c... 27046062
Nuclear receptor subfamily 1 group I member 2 EC50 = 31600.0 nM 4.5 Activation of human PXR expressed in human HepG2 (DPX-2) cells after 24 hrs by l... 20966043
Nuclear receptor subfamily 1 group I member 2 EC50 = 35500.0 nM 4.45 Activation of human PXR expressed in human HepG2 (DPX-2) cells assessed as induc... 20966043

Literature References

PubMed DOI Target Context # Activities
20966043 10.1124/dmd.110.035105 Nuclear receptor subfamily 1 group I member 2 8
9873375 10.1016/s0960-894x(98)00243-1 Gallus gallus 3
10476881 10.1016/s0960-894x(99)00393-5 Eimeria tenella 2
10476881 10.1016/s0960-894x(99)00393-5 Eimeria acervulina 2
34894691 10.1021/acs.jmedchem.1c01569 Toxoplasma gondii 2
- 10.6019/CHEMBL4808148 Histone deacetylase 6 2
- 10.6019/CHEMBL4651402 SARS-CoV-2 2
- 10.6019/CHEMBL4495565 SARS-CoV-2 2
38318365 10.1016/j.isci.2024.108907 Deoxynucleoside triphosphate triphosphohydrolase SAMHD1 1
- 10.6019/CHEMBL4495564 Replicase polyprotein 1ab 1
- 10.1101/2020.04.03.023846 SARS-CoV-2 1
27046062 10.1021/acs.jmedchem.5b01474 Polymerase acidic protein 1
27046062 10.1021/acs.jmedchem.5b01474 NON-PROTEIN TARGET 1
25856229 10.1021/acs.jmedchem.5b00012 Influenza A virus 1
25856229 10.1021/acs.jmedchem.5b00012 PA/PB1 1
2061927 10.1021/jm00110a023 NON-PROTEIN TARGET 1
8411009 10.1021/jm00072a012 Gallus gallus 1
1635056 10.1021/jm00092a004 Eimeria tenella 1

Data from ChEMBL 36 via Core Engine