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XMD17-109 - ≥98%, high purity , CAS No.1435488-37-1, Inhibitor of mitogen-activated protein kinase 7

Moligand™
≥98%

CAS#: 1435488-37-1
Formula: C₃₆H₄₆N₈O₃
Molecular Weight: 638.8
PubChem CID: 71604307
PubChem SID: 488202270

Item Number

X126572

Grouped product items
SKU	Size	Availability	Price
X126572-5mg	5mg	In stock	$96.90
X126572-25mg	25mg	In stock	$436.90
X126572-50mg	50mg	In stock	$454.90
X126572-100mg	100mg	In stock	$687.90
X126572-250mg	250mg	Available within 1-2 weeks(?) Item is derived from our semi-finished stock and is processed in 1-2 weeks.	$1,548.90

Potent and selective ERK5 inhibitor

View related series

mitogen-activated protein kinase 7 Inhibitor

Basic Description

Specifications & Purity	Moligand™, ≥98%
Biochemical and Physiological Mechanisms	Potent and selective ERK5 inhibitor; inhibits EGFR-induced ERK5 autophosphorylation (EC50= 90 nM) and ERK5 enzymatic activity (IC50= 162 nM). Exhibits at least 30-fold selectivity for ERK5 over LRRK2 in a cell based assay. Also selective for ERK5 over a p
Storage Temp	Store at -20°C
Shipped In	Ice chest + Ice pads
Grade	Moligand™
Action Type	INHIBITOR
Mechanism of action	Inhibitor of mitogen-activated protein kinase 7

Associated Targets

DCLK2 Tchem Serine/threonine-protein kinase DCLK2 0 Activities

Discover Target: DCLK2

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

BRD4 Tchem Bromodomain-containing protein 4 0 Activities

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Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

DCLK1 Tchem Serine/threonine-protein kinase DCLK1 1 Activities

Discover Target: DCLK1

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

CDK2 Tchem Cyclin-dependent kinase 2 0 Activities

Discover Target: CDK2

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

HDAC6 Tclin Histone deacetylase 6 0 Activities

Discover Target: HDAC6

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

FGFR3 Tclin Fibroblast growth factor receptor 3 0 Activities

Discover Target: FGFR3

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

CSNK1D Tchem Casein kinase I isoform delta 0 Activities

Discover Target: CSNK1D

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

TRIM24 Tchem Transcription intermediary factor 1-alpha 0 Activities

Discover Target: TRIM24

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

PLK4 Tchem Serine/threonine-protein kinase PLK4 0 Activities

Discover Target: PLK4

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

PLK1 Tchem Serine/threonine-protein kinase PLK1 0 Activities

Discover Target: PLK1

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

MAPK7 Tchem Mitogen-activated protein kinase 7 1 Activities

Discover Target: MAPK7

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

LRRK2 Tchem Leucine-rich repeat serine/threonine-protein kinase 2 0 Activities

Discover Target: LRRK2

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

BRDT Tchem Bromodomain testis-specific protein 0 Activities

Discover Target: BRDT

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

BRPF1 Tchem Peregrin 0 Activities

Discover Target: BRPF1

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

AURKA Tchem Aurora kinase A 0 Activities

Discover Target: AURKA

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

ABL1 Tclin Tyrosine-protein kinase ABL1 0 Activities

Discover Target: ABL1

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

GSK3B Tclin Glycogen synthase kinase-3 beta 0 Activities

Discover Target: GSK3B

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

MAPK1 Tchem Mitogen-activated protein kinase 1 0 Activities

Discover Target: MAPK1

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

Names and Identifiers

Pubchem Sid	488202270
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488202270
IUPAC Name	11-cyclopentyl-2-[2-ethoxy-4-[4-(4-methylpiperazin-1-yl)piperidine-1-carbonyl]anilino]-5-methylpyrimido[4,5-b][1,4]benzodiazepin-6-one
INCHI	InChI=1S/C36H46N8O3/c1-4-47-32-23-25(34(45)43-17-15-26(16-18-43)42-21-19-40(2)20-22-42)13-14-29(32)38-36-37-24-31-33(39-36)44(27-9-5-6-10-27)30-12-8-7-11-28(30)35(46)41(31)3/h7-8,11-14,23-24,26-27H,4-6,9-10,15-22H2,1-3H3,(H,37,38,39)
InChi Key	XVBGRTMNFNMINE-UHFFFAOYSA-N
Canonical SMILES	CCOC1=C(C=CC(=C1)C(=O)N2CCC(CC2)N3CCN(CC3)C)NC4=NC=C5C(=N4)N(C6=CC=CC=C6C(=O)N5C)C7CCCC7
Isomeric SMILES	CCOC1=C(C=CC(=C1)C(=O)N2CCC(CC2)N3CCN(CC3)C)NC4=NC=C5C(=N4)N(C6=CC=CC=C6C(=O)N5C)C7CCCC7
PubChem CID	71604307
Molecular Weight	638.8

CAS Registry No.

PubChem CID

ChEMBL Ligand

BindingDB Ligand

RCSB PDB Ligand

PubChem SID

Certificates

Certificate of Analysis(COA)

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11 results found

Lot Number	Certificate Type	Date	Item
C2315259	Certificate of Analysis	Feb 08, 2023	X126572
D23061003	Certificate of Analysis	Feb 08, 2023	X126572
D23061004	Certificate of Analysis	Feb 08, 2023	X126572
D23061006	Certificate of Analysis	Feb 08, 2023	X126572
D23061007	Certificate of Analysis	Feb 08, 2023	X126572
D23061008	Certificate of Analysis	Feb 08, 2023	X126572
D23061009	Certificate of Analysis	Feb 08, 2023	X126572
D23061010	Certificate of Analysis	Feb 08, 2023	X126572
D23061011	Certificate of Analysis	Feb 08, 2023	X126572
D2306772	Certificate of Analysis	Feb 08, 2023	X126572
D2306989	Certificate of Analysis	Feb 08, 2023	X126572

References

1. Deng X, Elkins JM, Zhang J, Yang Q, Erazo T, Gomez N, Choi HG, Wang J, Dzamko N, Lee JD et al.. (2013) Structural determinants for ERK5 (MAPK7) and leucine rich repeat kinase 2 activities of benzo[e]pyrimido-[5,4-b]diazepine-6(11H)-ones.. Eur J Med Chem, 70 (3): (758-67). [PMID:24239623]

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