S-49076 HYDROCHLORIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H22N4O4S.ClH
Molecular Weight	474.96
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

SMILES

Cl.O=C1CSC(=O)N1CC2=CC3=C(NC(=O)\C3=C/C4=CC(CN5CCOCC5)=CN4)C=C2

InChI

InChIKey=FPSAJUOIYZSJJA-NAIZSXBXSA-N

InChI=1S/C22H22N4O4S.ClH/c27-20-13-31-22(29)26(20)12-14-1-2-19-17(8-14)18(21(28)24-19)9-16-7-15(10-23-16)11-25-3-5-30-6-4-25;/h1-2,7-10,23H,3-6,11-13H2,(H,24,28);1H/b18-9-;

HIDE SMILES / InChI

Approval Year

Targets

Targets

Primary Target	Pharmacology	Potency
Hepatocyte growth factor receptor 54	Inhibitor 8,297	1.0 nM [IC50]
Tyrosine-protein kinase receptor UFO 14	Inhibitor 8,297	7.0 nM [IC50]
Tyrosine-protein kinase Mer 3	Inhibitor 8,297	2.0 nM [IC50]
Fibroblast growth factor receptor 6	Inhibitor 8,297
Tyrosine-protein kinase receptor UFO 14	Inhibitor 8,297	7.0 nM [IC50]
Hepatocyte growth factor receptor 54	Inhibitor 8,297	1.0 nM [IC50]
Fibroblast growth factor receptor 1 45	Antagonist 2,778	18.0 nM [IC50]
Fibroblast growth factor receptor 2 25	Antagonist 2,778	17.0 nM [IC50]
Fibroblast growth factor receptor 3 32	Antagonist 2,778	15.0 nM [IC50]

PubMed

PubMed

Show entries

Title	Date	PubMed
First-in-human phase I study of oral S49076, a unique MET/AXL/FGFR inhibitor, in advanced solid tumours.	2017 Aug	28624695
The MET/AXL/FGFR Inhibitor S49076 Impairs Aurora B Activity and Improves the Antitumor Efficacy of Radiotherapy.	2017 Oct	28619752

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Name

Type

Language

S-49076 HYDROCHLORIDE

Code

English

S-49076(HYDROCHLORIDE)

Code

English

3-(((3Z)-3-((4-(MORPHOLINOMETHYL)-1H-PYRROL-2-YL)METHYLENE)-2-OXO-INDOLIN-5-YL)METHYL)THIAZOLIDINE-2,4-DIONE HYDROCHLORIDE

Systematic Name

English

2,4-THIAZOLIDINEDIONE, 3-((2,3-DIHYDRO-3-((4-(4-MORPHOLINYLMETHYL)-1H-PYRROL-2-YL)METHYLENE)-2-OXO-1H-INDOL-5-YL)METHYL)-, HYDROCHLORIDE (1:1)

Systematic Name

English

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Code System

Code

Type

Description

FDA UNII

ALUH60KSL9

PRIMARY

PUBCHEM

101043621

PRIMARY

CAS

1265966-31-1

PRIMARY

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ACTIVE MOIETY


					65ZUU7MATU

S-49076

SUBSTANCE RECORD


					ALUH60KSL9

S-49076 HYDROCHLORIDE