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Compound Detail

CHEMBL5095079

POVORCITINIB
🧪 Phase III
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🧪 Phase III
Cc1n[nH]c(C)c1-c1cnn(C2(CC#N)CN(c3cc(F)c(C(=O)N[C@@H](C)C(F)(F)F)cc3F)C2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5095079
Name POVORCITINIB
Phase Phase III
Structure Type MOL
InChI Key MSGYSFWCPOBHEV-AWEZNQCLSA-N

Known Names

INCB-054707 Incb054707 Povorcitinib
6
Targets
17
Activities
1
Assay Types
0
PK Parameters
0
Publications
3
Known Names
4
Indications

Molecular Properties

507.5
MW (Da)
3.98
ALogP
6
HBA
2
HBD
102.6
PSA (Ų)
0.49
QED
1
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Single Enantiomer
USAN Stem -tinib
USAN Year 2023

Extended Properties

Molecular Formula C23H22F5N7O
MW 507.47
Aromatic Rings 3
Heavy Atoms 36
NP-Likeness -1.24

Indications

Hidradenitis Suppurativa Vitiligo Asthma Prurigo

Activity Summary

IC50 17 meas. best 7.12

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Tyrosine-protein kinase JAK1
CHEMBL2835
 IC50 7.12 7.12 75.0 1
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
CHEMBL3130
 IC50 6.6 6.6 250.0 2
Tyrosine-protein kinase receptor UFO
CHEMBL4895
 IC50 6.52 5.905 300.0 4
Tyrosine-protein kinase receptor TYRO3
CHEMBL5314
 IC50 6.52 6.52 300.0 2
Tyrosine-protein kinase JAK2
CHEMBL2971
 IC50 6.19 6.19 650.0 5
Tyrosine-protein kinase Mer
CHEMBL5331
 IC50 5.7 5.7 2000.0 3

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Tyrosine-protein kinase JAK1 IC50 = 75.0 nM 7.12 In Vitro JAK Kinase Assay: Compounds herein were tested for inhibitory activity ... -
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform IC50 = 250.0 nM 6.6 PI3Kdelta Scintillation Proximity Assay: [γ-33P]ATP (10 mCi/mL) was purchased fr... -
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform IC50 = 250.0 nM 6.6 PI3Kdelta Scintillation Proximity Assay: [γ-33P]ATP (10 mCi/mL) was purchased fr... -
Tyrosine-protein kinase receptor TYRO3 IC50 = 300.0 nM 6.52 TAM Enzymatic Assay: The kinase assay buffer contained 50 mM HEPES, pH7.5, 10 mM... -
Tyrosine-protein kinase receptor UFO IC50 = 300.0 nM 6.52 TAM Enzymatic Assay: The kinase assay buffer contained 50 mM HEPES, pH7.5, 10 mM... -
Tyrosine-protein kinase receptor TYRO3 IC50 = 300.0 nM 6.52 TAM Enzymatic Assay: The kinase assay buffer contained 50 mM HEPES, pH7.5, 10 mM... -
Tyrosine-protein kinase JAK2 IC50 = 650.0 nM 6.19 In Vitro JAK Kinase Assay: Compounds herein were tested for inhibitory activity ... -
Tyrosine-protein kinase JAK2 IC50 = 650.0 nM 6.19 In Vitro JAK Kinase Assay: The catalytic domains of human JAK1 (a.a. 837-1142), ... -
Tyrosine-protein kinase JAK2 IC50 = 650.0 nM 6.19 In Vitro JAK Kinase Assay: Compounds herein were tested for inhibitory activity ... -
Tyrosine-protein kinase JAK2 IC50 = 650.0 nM 6.19 Kinase Assay: Compounds herein were tested for inhibitory activity of JAK target... -
Tyrosine-protein kinase JAK2 IC50 = 650.0 nM 6.19 Kinase Assay: Compounds herein were tested for inhibitory activity of JAK target... -
Tyrosine-protein kinase Mer IC50 = 2000.0 nM 5.7 TAM Kinase Assay: The kinase assay buffer contained 50 mM HEPES, pH7.5, 10 mM Mg... -
Tyrosine-protein kinase receptor UFO IC50 = 2000.0 nM 5.7 TAM Kinase Assay: The kinase assay buffer contained 50 mM HEPES, pH7.5, 10 mM Mg... -
Tyrosine-protein kinase Mer IC50 = 2000.0 nM 5.7 Kinase Assay: The kinase assay buffer contained 50 mM HEPES, pH7.5, 10 mM MgCl2,... -
Tyrosine-protein kinase receptor UFO IC50 = 2000.0 nM 5.7 Kinase Assay: The kinase assay buffer contained 50 mM HEPES, pH7.5, 10 mM MgCl2,... -
Tyrosine-protein kinase Mer IC50 = 2000.0 nM 5.7 TAM Kinase Assay: The kinase assay buffer contained 50 mM HEPES, pH7.5, 10 mM Mg... -
Tyrosine-protein kinase receptor UFO IC50 = 2000.0 nM 5.7 TAM Kinase Assay: The kinase assay buffer contained 50 mM HEPES, pH7.5, 10 mM Mg... -

Data from ChEMBL 36 via Core Engine