futibatinib   Click here for help

GtoPdb Ligand ID: 9786

Synonyms: Example 2 [WO2013108809] | FGFR-IN-1 | Lytgobi® | TAS 120 | TAS-120 | TAS120
Approved drug PDB Ligand
futibatinib is an approved drug (FDA (2022), EMA (2023))
Compound class: Synthetic organic
Comment: Futibatinib (TAS-120) is a covalent (irreversible), non-selective FGFR inhibitor that was developed for anti-tumour activity [5]. It is claimed as Example 2 in patent WO2013108809 [4]. It can overcome acquired resistance to ATP-competitive FGFR inhibitors (such as infigratinib and zoligratinib) in intrahepatic cholangiocarcinomas that harbour FGFR2 kinase domain mutations [2]. A case study in a patient with metastatic cholangiocarcinoma, whose tumour had a FGFR2-CORO2B gene fusion and a pemigatinib-induced resistance mutation, demonstrated tumour shrinkage in response to futibatinib treatment [3].
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 108.39
Molecular weight 418.18
XLogP 2.77
No. Lipinski's rules broken 0
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Canonical SMILES C=CC(=O)N1CCC(C1)n1nc(c2c1ncnc2N)C#Cc1cc(OC)cc(c1)OC
Isomeric SMILES C=CC(=O)N1CC[C@@H](C1)n1nc(c2c1ncnc2N)C#Cc1cc(OC)cc(c1)OC
InChI InChI=1S/C22H22N6O3/c1-4-19(29)27-8-7-15(12-27)28-22-20(21(23)24-13-25-22)18(26-28)6-5-14-9-16(30-2)11-17(10-14)31-3/h4,9-11,13,15H,1,7-8,12H2,2-3H3,(H2,23,24,25)/t15-/m0/s1
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (FDA (2022), EMA (2023))
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
10879 futibatinib
Synonyms Click here for help
Example 2 [WO2013108809] | FGFR-IN-1 | Lytgobi® | TAS 120 | TAS-120 | TAS120
Database Links Click here for help
BindingDB Ligand 161389
CAS Registry No. 1448169-71-8 (source: WHO INN record)
ChEMBL Ligand CHEMBL3701238
GtoPdb PubChem SID 354702259
PubChem CID 71621331
Search Google for chemical match using the InChIKey KEIPNCCJPRMIAX-HNNXBMFYSA-N
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UniChem Compound Search for chemical match using the InChIKey KEIPNCCJPRMIAX-HNNXBMFYSA-N
UniChem Connectivity Search for chemical match using the InChIKey KEIPNCCJPRMIAX-HNNXBMFYSA-N