LDN 214117 - ≥98%(HPLC), high purity , CAS No.1627503-67-6, Inhibitor of activin A receptor type 1;Inhibitor of activin A receptor type IL;Inhibitor of bone morphogenetic protein receptor type IA;Inhibitor of transforming growth factor beta receptor 1

In stock
Item Number
L288873
Grouped product items
SKUSizeAvailabilityPrice Qty
L288873-5mg
5mg
3
$64.90
L288873-10mg
10mg
3
$118.90
L288873-25mg
25mg
2
$238.90
L288873-50mg
50mg
2
$412.90
L288873-100mg
100mg
2
$641.90

Potent and selective ALK2 inhibitor

Basic Description

Specifications & PurityMoligand™, ≥98%(HPLC)
Biochemical and Physiological MechanismsPotent and selective inhibitor of type I bone morphogenic protein (BMP) receptor ALK2 (IC50= 24 nM). Shows preference for ALK1 and ALK2 over ALK3 and 164-fold selectivity for BMP6 inhibition (IC50= 100 nM) over TGF-β1. Exhibits improved kinome selectivity
Storage TempStore at -20°C
Shipped InIce chest + Ice pads
GradeMoligand™
Action TypeINHIBITOR
Mechanism of actionInhibitor of activin A receptor type 1;Inhibitor of activin A receptor type IL;Inhibitor of bone morphogenetic protein receptor type IA;Inhibitor of transforming growth factor beta receptor 1

Associated Targets(Human)

TGFBR1 Tchem TGF-beta receptor type-1 (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
BMPR1A Tchem Bone morphogenetic protein receptor type-1A (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
ACVR1 Tchem Activin receptor type-1 (5 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
ACVRL1 Tchem Serine/threonine-protein kinase receptor R3 (2 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
TGFBR1 Tchem TGF-beta receptor type I (3786 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
RIPK2 Tchem Serine/threonine-protein kinase RIPK2 (1546 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HepG2 (196354 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
BMPR1A Tchem Bone morphogenetic protein receptor type-1A (678 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ACVRL1 Tchem Serine/threonine-protein kinase receptor R3 (538 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ACVR1 Tchem Activin receptor type-1 (1516 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
NOD2 Tclin Nucleotide-binding oligomerization domain-containing protein 2 (1613 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID

Associated Targets(non-human)

rep Replicase polyprotein 1ab (378 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID

Mechanisms of Action

Mechanism of ActionAction Typetarget IDTarget NameTarget TypeTarget OrganismBinding Site NameReferences

Names and Identifiers

Pubchem Sid504772656
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504772656
IUPAC Name 1-[4-[6-methyl-5-(3,4,5-trimethoxyphenyl)pyridin-3-yl]phenyl]piperazine
INCHI InChI=1S/C25H29N3O3/c1-17-22(19-14-23(29-2)25(31-4)24(15-19)30-3)13-20(16-27-17)18-5-7-21(8-6-18)28-11-9-26-10-12-28/h5-8,13-16,26H,9-12H2,1-4H3
InChi Key BHUXVRVMMYAXKN-UHFFFAOYSA-N
Canonical SMILES CC1=C(C=C(C=N1)C2=CC=C(C=C2)N3CCNCC3)C4=CC(=C(C(=C4)OC)OC)OC
Isomeric SMILES CC1=C(C=C(C=N1)C2=CC=C(C=C2)N3CCNCC3)C4=CC(=C(C(=C4)OC)OC)OC
PubChem CID 91754554
Molecular Weight 419.52

Certificates(CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

5 results found

Lot NumberCertificate TypeDateItem
K2219489Certificate of AnalysisSep 05, 2022 L288873
K2219490Certificate of AnalysisSep 05, 2022 L288873
K2219496Certificate of AnalysisSep 05, 2022 L288873
K2219506Certificate of AnalysisSep 05, 2022 L288873
K2219505Certificate of AnalysisSep 05, 2022 L288873

Chemical and Physical Properties

SolubilitySolvent:DMSO, Max Conc. mg/mL: 41.95, Max Conc. mM: 100; Solvent:ethanol, Max Conc. mg/mL: 41.95, Max Conc. mM: 100
Molecular Weight419.500 g/mol
XLogP33.900
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Exact Mass419.221 Da
Monoisotopic Mass419.221 Da
Topological Polar Surface Area55.900 Ų
Heavy Atom Count31
Formal Charge0
Complexity522.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1

Specifications

References

1. Shore EM, Xu M, Feldman GJ, Fenstermacher DA, Cho TJ, Choi IH, Connor JM, Delai P, Glaser DL, LeMerrer M et al..  (2006)  A recurrent mutation in the BMP type I receptor ACVR1 causes inherited and sporadic fibrodysplasia ossificans progressiva..  Nat Genet,  38  (5): (525-7).  [PMID:16642017] [10.1021/op500134e]
2. Kaplan FS, Xu M, Seemann P, Connor JM, Glaser DL, Carroll L, Delai P, Fastnacht-Urban E, Forman SJ, Gillessen-Kaesbach G et al..  (2009)  Classic and atypical fibrodysplasia ossificans progressiva (FOP) phenotypes are caused by mutations in the bone morphogenetic protein (BMP) type I receptor ACVR1..  Hum Mutat,  30  (3): (379-90).  [PMID:19085907] [10.1021/op500134e]
3. Pignolo RJ, Shore EM, Kaplan FS.  (2011)  Fibrodysplasia ossificans progressiva: clinical and genetic aspects..  Orphanet J Rare Dis,  (13): (80).  [PMID:22133093] [10.1021/op500134e]
4. Nakahara Y, Katagiri T, Ogata N, Haga N.  (2014)  ACVR1 (587T>C) mutation in a variant form of fibrodysplasia ossificans progressiva: second report..  Am J Med Genet A,  164A  (1): (220-4).  [PMID:24259422] [10.1021/op500134e]
5. Mohedas AH, Wang Y, Sanvitale CE, Canning P, Choi S, Xing X, Bullock AN, Cuny GD, Yu PB.  (2014)  Structure-activity relationship of 3,5-diaryl-2-aminopyridine ALK2 inhibitors reveals unaltered binding affinity for fibrodysplasia ossificans progressiva causing mutants..  J Med Chem,  57  (19): (7900-15).  [PMID:25101911] [10.1021/op500134e]

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