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LY2940680 - ≥99%, high purity , Smoothened homolog antagonist, CAS No.1258861-20-9, Smoothened homolog antagonist

Moligand™

≥99%

CAS#: 1258861-20-9
Formula: C₂₆H₂₄F₄N₆O
Molecular Weight: 512.5
PubChem CID: 49848070

Item Number

L125247

Grouped product items
SKU	Size	Availability	Price
L125247-5mg	5mg	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$118.90
L125247-10mg	10mg	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$190.90
L125247-50mg	50mg	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$532.90

Potent Hedgehog signaling pathway inhibitor

View related series

Smo SMO Antagonist Stem Cell/Wnt

Basic Description

Synonyms	CCG-269788 \| BCP9000881 \| DTXSID50154986 \| Taladegib (LY2940680) \| EX-A156 \| LY 2940680 \| NCGC00263170-06 \| J-515412 \| 1258861-20-9 \| DB12550 \| UNII-QY8BWX1LJ5 \| 1KS \| IEISBKIVLDXSMZ-UHFFFAOYSA-N \| MFCD21609264 \| R06AD04 \| Taladegib \| HMS2230I06 \| LY29406
Specifications & Purity	Moligand™, ≥99%
Biochemical and Physiological Mechanisms	Potent Hedgehog signaling pathway inhibitor. Smoothened antagonist. Inhibits growth of cancer cell lines containing a disease-relevant\xa0Smoothened gene mutation. Has anti-tumor activity in animal models.
Storage Temp	Store at -20°C
Shipped In	Ice chest + Ice pads
Grade	Moligand™
Action Type	ANTAGONIST
Mechanism of action	Smoothened homolog antagonist
Note	Toxic, refer to SDS for further information . Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.
Product Description	LY2940680 binds to the Smoothened (Smo) receptor and potently inhibits Hedgehog (Hh) signaling. Phase 1/2.

Associated Targets(Human)

SMO Tclin Smoothened homolog (2 Activities)

Discover Target: SMO

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

A2058 (690 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Daoy (570 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

SMO Tclin Smoothened homolog (1371 Activities)

Discover Target: SMO

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Associated Targets(non-human)

Mapk1 MAP kinase ERK2 (650 Activities)

Discover Target: Mapk1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Hdac6 Histone deacetylase 6 (222 Activities)

Discover Target: Hdac6

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

rep Replicase polyprotein 1ab (378 Activities)

Discover Target: rep

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Names and Identifiers

IUPAC Name	4-fluoro-N-methyl-N-[1-[4-(2-methylpyrazol-3-yl)phthalazin-1-yl]piperidin-4-yl]-2-(trifluoromethyl)benzamide
INCHI	InChI=1S/C26H24F4N6O/c1-34(25(37)20-8-7-16(27)15-21(20)26(28,29)30)17-10-13-36(14-11-17)24-19-6-4-3-5-18(19)23(32-33-24)22-9-12-31-35(22)2/h3-9,12,15,17H,10-11,13-14H2,1-2H3
InChi Key	SZBGQDXLNMELTB-UHFFFAOYSA-N
Canonical SMILES	CN1C(=CC=N1)C2=NN=C(C3=CC=CC=C32)N4CCC(CC4)N(C)C(=O)C5=C(C=C(C=C5)F)C(F)(F)F
Isomeric SMILES	CN1C(=CC=N1)C2=NN=C(C3=CC=CC=C32)N4CCC(CC4)N(C)C(=O)C5=C(C=C(C=C5)F)C(F)(F)F
PubChem CID	49848070
Molecular Weight	512.5

CAS Registry No.

PubChem CID

ChEMBL Ligand

RCSB PDB Ligand

GPCRdb Ligand

Lot Number

Certificate Type

Date

Item

J1520093

Certificate of Analysis

May 10, 2023

L125247

Safety and Hazards(GHS)

Pictogram(s)	GHS08
Signal	Danger
Hazard Statements	H373:Causes damage to organs through prolonged or repeated exposure H360:May damage fertility or the unborn child
Precautionary Statements	P280:Wear protective gloves/protective clothing/eye protection/face protection. P405:Store locked up. P501:Dispose of contents/container to ... P260:Do not breathe dust/fume/gas/mist/vapors/spray. P203:Obtain, read and follow all safety instructions before use. P318:if exposed or concerned, get medical advice. P319:Get medical help if you feel unwell.

References

1. Lu X, Peng Y, Wang C, Yang J, Bao X, Dong Q, Zhao W, Tan W, Dong X. (2017) Design, synthesis, and biological evaluation of optimized phthalazine derivatives as hedgehog signaling pathway inhibitors.. Eur J Med Chem, 138 (13): (384-395). [PMID:28688278] [10.1021/op500134e]
2. Bendell J, Andre V, Ho A, Kudchadkar R, Migden M, Infante J, Tiu RV, Pitou C, Tucker T, Brail L et al.. (2018) Phase I Study of LY2940680, a Smo Antagonist, in Patients with Advanced Cancer Including Treatment-Naïve and Previously Treated Basal Cell Carcinoma.. Clin Cancer Res, 24 (9): (2082-2091). [PMID:29483143] [10.1021/op500134e]

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LY2940680 - ≥99%, high purity , Smoothened homolog antagonist, CAS No.1258861-20-9, Smoothened homolog antagonist

Basic Description

Product Properties

Associated Targets(Human)

Associated Targets(non-human)

Mechanisms of Action

Names and Identifiers

Database links

Certificates

Certificate of Analysis(COA)

Chemical and Physical Properties

Safety and Hazards(GHS)

Related Documents

References

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