Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C20H27N7O3S.ClH |
| Molecular Weight | 481.999 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.CCS(=O)(=O)N1CCN(CC1)C2=CC=C(NC3=NC=C(C(N)=O)C(NC4CC4)=N3)C=C2
InChI
InChIKey=IYULGYKOHUAYCG-UHFFFAOYSA-N
InChI=1S/C20H27N7O3S.ClH/c1-2-31(29,30)27-11-9-26(10-12-27)16-7-5-15(6-8-16)24-20-22-13-17(18(21)28)19(25-20)23-14-3-4-14;/h5-8,13-14H,2-4,9-12H2,1H3,(H2,21,28)(H2,22,23,24,25);1H
| Molecular Formula | ClH |
| Molecular Weight | 36.461 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C20H27N7O3S |
| Molecular Weight | 445.538 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
DescriptionCurator's Comment: Description was created based on several sources, including https://www.ncbi.nlm.nih.gov/pubmed/25253883
Curator's Comment: Description was created based on several sources, including https://www.ncbi.nlm.nih.gov/pubmed/25253883
Cerdulatinib is an oral, dual spleen tyrosine kinase (Syk) and janus kinase (JAK) inhibitor that uniquely inhibits two key cell signaling pathways that promote cancer cell growth in certain hematologic malignancies – the B-cell receptor pathway via Syk and key cytokine receptors via JAK Being developed to treat patients with hematologic cancers, specifically those who have relapsed or who have not responded to prior therapies. Cerdulatinib is in Phase 2 study evaluating the safety and efficacy of cerdulatinib in patients with relapsed/refractory B-cell malignancies who have failed multiple therapies.
Originator
Approval Year
Targets
| Primary Target | Pharmacology | Condition | Potency |
|---|---|---|---|
Target ID: CHEMBL3553 |
0.5 nM [IC50] | ||
Target ID: CHEMBL2599 |
32.0 nM [IC50] | ||
Target ID: CHEMBL2148 |
8.0 nM [IC50] | ||
Target ID: CHEMBL2835 |
12.0 nM [IC50] | ||
Target ID: CHEMBL2971 |
6.0 nM [IC50] | ||
Target ID: CHEMBL4598 |
4.0 nM [IC50] | ||
Target ID: CHEMBL5784 |
4.0 nM [IC50] | ||
Target ID: CHEMBL2872 |
5.0 nM [IC50] |
Conditions
| Condition | Modality | Targets | Highest Phase | Product |
|---|---|---|---|---|
| Primary | Unknown Approved UseUnknown |
|||
| Primary | Unknown Approved UseUnknown |
|||
| Primary | Unknown Approved UseUnknown |
Sample Use Guides
Rat: in a rat collagen-induced arthritis model, Cerdulatinib (5 mg/kg p.o.) significantly improves inflammatory infiltrate within the synovium and the integrity of the articular cartilage.
Route of Administration:
Oral
In biochemical assays, cerdulatinib demonstrated inhibitory activity against 24 kinases with IC50’s < 200 nM. Cerdulatinib demonstrated sensitivity to cerdulatinib with IC50 at or below ~2 uM. ABC cell lines with relatively higher total and phosphorylated STAT3 displayed good sensitivity to the drug with IC50 ranging from 0.29 to 1.80 uM.
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 14:51:21 GMT 2023
by
admin
on
Sat Dec 16 14:51:21 GMT 2023
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| Record UNII |
L1KRM66Y4X
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| Record Status |
Validated (UNII)
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| Record Version |
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1369761-01-2
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56960607
Created by
admin on Sat Dec 16 14:51:21 GMT 2023 , Edited by admin on Sat Dec 16 14:51:21 GMT 2023
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L1KRM66Y4X
Created by
admin on Sat Dec 16 14:51:21 GMT 2023 , Edited by admin on Sat Dec 16 14:51:21 GMT 2023
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