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PHA-408 , CAS No.503555-55-3, Inhibitor of component of inhibitor of nuclear factor kappa B kinase complex;Inhibitor of inhibitor of nuclear factor kappa B kinase subunit beta

Moligand™

CAS#: 503555-55-3
Formula: C₂₉H₂₇ClFN₇O₂
Molecular Weight: 560.02
PubChem CID: 22291652

Item Number

P612779

Grouped product items
SKU	Size	Availability	Price	Qty
P612779-5mg	5mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,334.90
P612779-25mg	25mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,001.90

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component of inhibitor of nuclear factor kappa B kinase complex Inhibitor inhibitor of nuclear factor kappa B kinase subunit beta Inhibitor

Basic Description

Synonyms	PHA-408\|503555-55-3\|PHA 408\|PHA408\|8-(5-Chloro-2-(4-methylpiperazin-1-yl)isonicotinamido)-1-(4-fluorophenyl)-4,5-dihydro-1H-benzo[g]indazole-3-carboxamide\|8K8XT2KBG3\|CHEMBL592893\|8-[[5-chloro-2-(4-methylpiperazin-1-yl)pyridine-4-carbonyl]amino]-1-(4-fluor
Specifications & Purity	Moligand™
Grade	Moligand™
Action Type	INHIBITOR
Mechanism of action	Inhibitor of component of inhibitor of nuclear factor kappa B kinase complex;Inhibitor of inhibitor of nuclear factor kappa B kinase subunit beta

Associated Targets

IKBKE Tchem Inhibitor of nuclear factor kappa-B kinase subunit epsilon 0 Activities

Discover Target: IKBKE

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

CHUK Tchem Inhibitor of nuclear factor kappa-B kinase subunit alpha 1 Activities

Discover Target: CHUK

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

IKBKB Tchem Inhibitor of nuclear factor kappa-B kinase subunit beta 3 Activities

Discover Target: IKBKB

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

TBK1 Tchem Serine/threonine-protein kinase TBK1 0 Activities

Discover Target: TBK1

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

Names and Identifiers

IUPAC Name	8-[[5-chloro-2-(4-methylpiperazin-1-yl)pyridine-4-carbonyl]amino]-1-(4-fluorophenyl)-4,5-dihydrobenzo[g]indazole-3-carboxamide
INCHI	InChI=1S/C29H27ClFN7O2/c1-36-10-12-37(13-11-36)25-15-23(24(30)16-33-25)29(40)34-19-6-2-17-3-9-21-26(28(32)39)35-38(27(21)22(17)14-19)20-7-4-18(31)5-8-20/h2,4-8,14-16H,3,9-13H2,1H3,(H2,32,39)(H,34,40)
InChi Key	ZLEZHGHFWIHCGU-UHFFFAOYSA-N
Canonical SMILES	CN1CCN(CC1)C2=NC=C(C(=C2)C(=O)NC3=CC4=C(CCC5=C4N(N=C5C(=O)N)C6=CC=C(C=C6)F)C=C3)Cl
Isomeric SMILES	CN1CCN(CC1)C2=NC=C(C(=C2)C(=O)NC3=CC4=C(CCC5=C4N(N=C5C(=O)N)C6=CC=C(C=C6)F)C=C3)Cl
PubChem CID	22291652
Molecular Weight	560.02

PubChem CID

ChEMBL Ligand

BindingDB Ligand

CAS Registry No.

References

1. Mbalaviele G, Sommers CD, Bonar SL, Mathialagan S, Schindler JF, Guzova JA, Shaffer AF, Melton MA, Christine LJ, Tripp CS et al.. (2009) A novel, highly selective, tight binding IkappaB kinase-2 (IKK-2) inhibitor: a tool to correlate IKK-2 activity to the fate and functions of the components of the nuclear factor-kappaB pathway in arthritis-relevant cells and animal models.. J Pharmacol Exp Ther, 329 (1): (14-25). [PMID:19168710]
2. Xie J, Poda GI, Hu Y, Chen NX, Heier RF, Wolfson SG, Reding MT, Lennon PJ, Kurumbail RG, Selness SR et al.. (2011) Aminopyridinecarboxamide-based inhaled IKK-2 inhibitors for asthma and COPD: Structure-activity relationship.. Bioorg Med Chem, 19 (3): (1242-55). [PMID:21236687]

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PHA-408 , CAS No.503555-55-3, Inhibitor of component of inhibitor of nuclear factor kappa B kinase complex;Inhibitor of inhibitor of nuclear factor kappa B kinase subunit beta

Basic Description

Associated Targets

IKBKE Tchem Inhibitor of nuclear factor kappa-B kinase subunit epsilon 0 Activities

CHUK Tchem Inhibitor of nuclear factor kappa-B kinase subunit alpha 1 Activities

IKBKB Tchem Inhibitor of nuclear factor kappa-B kinase subunit beta 3 Activities

TBK1 Tchem Serine/threonine-protein kinase TBK1 0 Activities

Names and Identifiers

Database links

Certificates

Certificate of Analysis(COA)

Safety and Hazards(GHS)

Related Documents

References

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