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ChemicalBook--->CAS DataBase List--->2944101-99-7

2944101-99-7

2944101-99-7 Structure

2944101-99-7 Structure
IdentificationBack Directory
[Name]

PARP1/c-Met-IN-1
[CAS]

2944101-99-7
[Synonyms]

PARP1/c-Met-IN-1
[Molecular Formula]

C40H33FN8O4
[MOL File]

2944101-99-7.mol
[Molecular Weight]

708.74
Chemical PropertiesBack Directory
[density ]

1.40±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)
[pka]

12.07±0.40(predicted)
Hazard InformationBack Directory
[Uses]

PARP1/c-Met-IN-1 (Compound 16) is a selective dual inhibitor for PARP1 and c-Met, with IC50s of 3.3 and 32.2 nM, respectively. PARP1/c-Met-IN-1 induces cell apoptosis and cell cycle arrest in G2/M phase in MDA-MB-231 cells. PARP1/c-Met-IN-1 exhibits antitumor activity in mice[1].
[in vivo]

PARP1/c-Met-IN-1 (12.5-100 mg/kg, i.p. for 28 days) exhibits antitumor efficacy with tumor growth inhibition (TGI) values of 49-77 % and 62-70 % in MDA-MB-231 and HCT116OR xenograft nude mice, respectively[1].

Pharmacokinetic Analysis of PARP1/c-Met-IN-1 in BALB/c mice[1]

routeDose (mg/kg)T1/2 (h)Tmax (h)Cmax (ng/mL)AUC0-t (ng·h/mL)AUC0-inf (ng·h/mL)MRT0-t (h)MRT0-inf (h)CLblood (mL/h/kg)
i.p.101.420.25152.4795.4296.701.671.77121232
Animal Model:MDA-MB-231 and HCT116OR xenograft BALB/c nude mice[1]
Dosage:12.5-50 mg/kg for MDA-MB-231 xenograft mice, 20-100 mg/kg for HCT116OR xenograft mice
Administration:I.p., 21 days for HCT116OR xenograft mice, 28 days for MDA-MB-231 xenograft mice
Result:Inhibited tumor growth with TGI of 49-77% in MDA-MB-231 xenograft mice.
Inhibited tumor growth with TGI of 62-70% in HCT116OR xenograft mice.
[IC 50]

PARP1: 3.3 nM (IC50); c-Met: 32.2 nM (IC50)
[References]

[1] Sun Z, et al., Rational Design of PARP1/c-Met Dual Inhibitors for Overcoming PARP1 Inhibitor Resistance Induced by c-Met Overexpression. J Med Chem. 2024 Mar 28;67(6):4916-4935. DOI:10.1021/acs.jmedchem.4c00077
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