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Compound Detail

CHEMBL4303596

AMG-319
🧪 Phase II
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🧪 Phase II
C[C@H](Nc1ncnc2[nH]cnc12)c1cc2ccc(F)cc2nc1-c1ccccn1

Basic Information

ChEMBL ID CHEMBL4303596
Name AMG-319
Phase Phase II
Structure Type MOL
InChI Key KWRYMZHCQIOOEB-LBPRGKRZSA-N

Known Names

Amg-319 AMG319 J3.391.906I
6
Targets
7
Activities
1
Assay Types
7
PK Parameters
15
Publications
3
Known Names
5
Indications
1
Mechanisms

Molecular Properties

385.4
MW (Da)
4.28
ALogP
6
HBA
2
HBD
92.3
PSA (Ų)
0.48
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Single Enantiomer

Extended Properties

Molecular Formula C21H16FN7
MW 385.41
Aromatic Rings 5
Heavy Atoms 29
NP-Likeness -1.27

Mechanism of Action

Mechanism Action Type Target Direct Efficacy
PI3-kinase p110-delta subunit inhibitor INHIBITOR Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform

Indications

Carcinoma, Squamous Cell Leukemia, Lymphocytic, Chronic, B-Cell Lymphoma, Large B-Cell, Diffuse Lymphoma, Mantle-Cell Neoplasms

Activity Summary

IC50 7 meas. best 8.82

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
CHEMBL2216745
IC50 8.82 8.82 1.5 1
B cell
CHEMBL5314312
IC50 8.07 8.07 8.6 1
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
CHEMBL3130
IC50 7.96 7.855 10.9 2
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
CHEMBL3267
IC50 6.07 6.07 850.0 1
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform
CHEMBL3145
IC50 5.57 5.57 2700.0 1
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
CHEMBL4005
IC50 4.48 4.48 33000.0 1

Pharmacokinetic Data

Parameter Value Units Species
CL 14.0 mL.min-1.g-1 Rattus norvegicus
CL 14.0 mL.min-1.g-1 Homo sapiens
CL 5.0 mL.min-1.kg-1 Rattus norvegicus
CL 45.0 mL.min-1.kg-1 Rattus norvegicus
F 54.0 % Rattus norvegicus
Fu 0.16 - Homo sapiens
Fu 0.12 - Rattus norvegicus

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
27411843 10.1021/acs.jmedchem.6b00827 ADMET 8
27411843 10.1021/acs.jmedchem.6b00827 Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform 4
- 10.6019/CHEMBL4495565 SARS-CoV-2 4
- 10.6019/CHEMBL4808148 Histone deacetylase 6 4
27411843 10.1021/acs.jmedchem.6b00827 Unchecked 3
- 10.21203/rs.3.rs-23951/v1 SARS-CoV-2 2
27411843 10.1021/acs.jmedchem.6b00827 Nuclear receptor subfamily 1 group I member 2 2
- 10.6019/CHEMBL4495564 Replicase polyprotein 1ab 2
27411843 10.1021/acs.jmedchem.6b00827 Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform 1
27411843 10.1021/acs.jmedchem.6b00827 Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform 1
27411843 10.1021/acs.jmedchem.6b00827 Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform 1
27411843 10.1021/acs.jmedchem.6b00827 B cell 1
27411843 10.1021/acs.jmedchem.6b00827 Cytochrome P450 3A4 1
27411843 10.1021/acs.jmedchem.6b00827 Cytochrome P450 2D6 1
27411843 10.1021/acs.jmedchem.6b00827 No relevant target 1

Data from ChEMBL 36 via Core Engine