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

CHEMBL4078100

AZD-5153
Phase I
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 I
COc1nnc2ccc(N3CCC(c4ccc(OCCN5CCN(C)C(=O)[C@H]5C)cc4)CC3)nn12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4078100
Name AZD-5153
Phase Phase I
Structure Type MOL
InChI Key RSMYFSPOTCDHHJ-GOSISDBHSA-N

Known Names

Azd 5153 Azd-5153 Azd5153
9
Targets
35
Activities
3
Assay Types
7
PK Parameters
20
Publications
3
Known Names
3
Indications

Molecular Properties

479.6
MW (Da)
2.06
ALogP
9
HBA
0
HBD
88.3
PSA (Ų)
0.51
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Single Enantiomer

Flags

Chemical Probe

Extended Properties

Molecular Formula C25H33N7O3
MW 479.59
Aromatic Rings 3
Heavy Atoms 35
NP-Likeness -1.48

Indications

Leukemia, Myeloid, Acute Lymphoma, Large B-Cell, Diffuse Lymphoma, Non-Hodgkin

Activity Summary

IC50 18 meas. best 8.5
Ki 16 meas. best 8.3
EC50 1 meas. best 7.8

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
C-C motif chemokine 2
CHEMBL1649052
 IC50 8.5 8.15 3.2 2
Bromodomain-containing protein 4
CHEMBL1163125
 IC50 8.3 7.5047 5.0 15
Bromodomain-containing protein 4
CHEMBL1163125
 Ki 8.3 7.4167 5.0 6
Bromodomain-containing protein 4
CHEMBL1163125
 EC50 7.8 7.8 15.8 1
Bromodomain-containing protein 3
CHEMBL1795186
 Ki 7.2 6.8 63.1 2
Bromodomain-containing protein 2
CHEMBL1293289
 Ki 7.0 6.8 100.0 2
Bromodomain testis-specific protein
CHEMBL1795185
 Ki 7.0 6.65 100.0 2
Transcription initiation factor TFIID subunit 1
CHEMBL3217390
 Ki 5.9 5.9 1258.9 1
Bromodomain-containing protein 9
CHEMBL3108640
 Ki 5.6 5.6 2511.9 1
Transcription initiation factor TFIID subunit 1-like
CHEMBL3108641
 Ki 5.6 5.6 2511.9 1
CREB-binding protein
CHEMBL5747
 Ki 5.2 5.2 6309.6 1

Pharmacokinetic Data

Parameter Value Units Species
CL 4.0 mL.min-1.kg-1 Rattus norvegicus
CL 6.0 mL.min-1.kg-1 Canis lupus familiaris
F 81.0 % Rattus norvegicus
F 55.0 % Canis lupus familiaris
Fu 0.04 - Rattus norvegicus
Fu 0.24 - Canis lupus familiaris
Fu 0.23 - Homo sapiens

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
C-C motif chemokine 2 IC50 = 3.162 nM 8.5 Inhibition of MCP-1 in LPS-stimulated human PBMC cells pretreated with compound ... 37736196
Bromodomain-containing protein 4 IC50 = 5.0 nM 8.3 Displacement of Halo-tagged histone H3.3 from NanoLuc-tagged full length BRD4 (u... 28195723
Bromodomain-containing protein 4 IC50 = 5.0 nM 8.3 Inhibition of full-length NanoLuc-tagged BRD4 (1 to 1362 residues) (unknown orig... 30542529
Bromodomain-containing protein 4 IC50 = 5.0 nM 8.3 Inhibition of BRD4 (unknown origin) 33460833
Bromodomain-containing protein 4 IC50 = 5.0 nM 8.3 Inhibition of BRD4 BD1 (unknown origin) by chromatin/BRD4 displacement assay 33460833
Bromodomain-containing protein 4 IC50 = 5.0 nM 8.3 Inhibition of BRD4 BD2 (unknown origin) by chromatin/BRD4 displacement assay 33460833
Bromodomain-containing protein 4 IC50 = 5.0 nM 8.3 Inhibition of full length BRD4 (unknown origin) incubated for 18 hrs 32502863
Bromodomain-containing protein 4 Ki = 5.012 nM 8.3 Displacement of Alexa647-labeled JQ1 derivative from wild type BRD4 tandem domai... 27528113
Bromodomain-containing protein 4 Ki = 5.0 nM 8.3 Inhibition of BRD4 (unknown origin) 31188592
Bromodomain-containing protein 4 IC50 = 5.4 nM 8.27 Inhibition of BRD4 in human MM1S cells assessed as down regulation of c-Myc expr... 30542529
Bromodomain-containing protein 4 IC50 = 12.59 nM 7.9 Inhibition of BRD4 in human MM1S cells assessed as down regulation of c-Myc incu... 27528113
C-C motif chemokine 2 IC50 = 15.85 nM 7.8 Inhibition of MCP-1 in LPS-stimulated human whole blood pretreated with compound... 37736196
Bromodomain-containing protein 4 IC50 = 15.85 nM 7.8 Inhibition of histone binding to BRD4 (unknown origin) expressed in HEK293 cells... 37736196
Bromodomain-containing protein 4 EC50 = 15.85 nM 7.8 Inhibition of halo-tagged BRD4 (unknown origin) expressed in HEK293 cells incuba... 37736196
Bromodomain-containing protein 4 IC50 = 19.95 nM 7.7 Inhibition of BRD4 in human LNCAP cells assessed as down regulation of nuclear A... 27528113
Bromodomain-containing protein 4 IC50 = 25.12 nM 7.6 Inhibition of BRD4 in human MCF7 cells assessed as down regulation of ERalpha af... 27528113
Bromodomain-containing protein 4 Ki = 50.12 nM 7.3 Inhibition of human BRD4 bromodomain 1 expressed in bacterial expression system 27528113
Bromodomain-containing protein 3 Ki = 63.1 nM 7.2 Inhibition of human BRD3 bromodomain 1 expressed in bacterial expression system 27528113
Bromodomain-containing protein 2 Ki = 100.0 nM 7.0 Inhibition of human BRD2 bromodomain 1 expressed in bacterial expression system 27528113
Bromodomain testis-specific protein Ki = 100.0 nM 7.0 Inhibition of human BRDT bromodomain 1 expressed in bacterial expression system 27528113

Literature References

PubMed DOI Target Context # Activities
27528113 10.1021/acs.jmedchem.6b00070 ADMET 15
27528113 10.1021/acs.jmedchem.6b00070 Bromodomain-containing protein 4 8
37736196 10.1021/acsmedchemlett.3c00242 Bromodomain-containing protein 4 5
33460833 10.1016/j.ejmech.2020.113137 Bromodomain-containing protein 4 3
30542529 10.1039/C8MD00198G Bromodomain-containing protein 4 3
27528113 10.1021/acs.jmedchem.6b00070 No relevant target 3
28195723 10.1021/acs.jmedchem.6b01761 Bromodomain-containing protein 4 2
32502863 10.1016/j.ejmech.2020.112426 Bromodomain-containing protein 4 2
37736196 10.1021/acsmedchemlett.3c00242 C-C motif chemokine 2 2
27528113 10.1021/acs.jmedchem.6b00070 Bromodomain testis-specific protein 2
27528113 10.1021/acs.jmedchem.6b00070 Bromodomain-containing protein 3 2
27528113 10.1021/acs.jmedchem.6b00070 Bromodomain-containing protein 2 2
27528113 10.1021/acs.jmedchem.6b00070 MV4-11 1
27528113 10.1021/acs.jmedchem.6b00070 Mus musculus 1
27528113 10.1021/acs.jmedchem.6b00070 Transcription initiation factor TFIID subunit 1 1
27528113 10.1021/acs.jmedchem.6b00070 Bromodomain-containing protein 9 1
27528113 10.1021/acs.jmedchem.6b00070 MM1.S 1
27528113 10.1021/acs.jmedchem.6b00070 Histone acetyltransferase p300 1
30542529 10.1039/C8MD00198G MV4-11 1
31188592 10.1021/acs.jmedchem.8b01732 Bromodomain-containing protein 4 1

Data from ChEMBL 36 via Core Engine