Preferred Name

nintedanib

Synonyms

BIBF1120

nintedanib

methyl (3Z)-3-[(4-{methyl[(4-methylpiperazin-1-yl)acetyl]amino}anilino)(phenyl)methylidene]-2-oxo-2,3-dihydro-1H-indole-6-carboxylate

BIBF 1120

BIBF-1120

Definitions

A member of the class of oxindoles that is a kinase inhibitor used (in the form of its ethylsulfonate salt) for the treatment of idiopathic pulmonary fibrosis and cancer.

ID

http://purl.obolibrary.org/obo/CHEBI_85164

charge

0

database_cross_reference

PMID:25430078

Drug_Central:4903

PMID:25571784

PDBeChem:XIN

PMID:25745043

PMID:25534294

Wikipedia:Nintedanib

PMID:25474320

CAS:656247-17-5

PMID:24657398

Reaxys:12016593

PMID:25338318

PMID:25527450

KEGG:D10481

PMID:25299232

PMID:25478720

definition

A member of the class of oxindoles that is a kinase inhibitor used (in the form of its ethylsulfonate salt) for the treatment of idiopathic pulmonary fibrosis and cancer.

formula

C31H33N5O4

has role

http://purl.obolibrary.org/obo/CHEBI_35610

http://purl.obolibrary.org/obo/CHEBI_48422

http://purl.obolibrary.org/obo/CHEBI_63457

http://purl.obolibrary.org/obo/CHEBI_38637

http://purl.obolibrary.org/obo/CHEBI_65207

has_exact_synonym

methyl (3Z)-3-[(4-{methyl[(4-methylpiperazin-1-yl)acetyl]amino}anilino)(phenyl)methylidene]-2-oxo-2,3-dihydro-1H-indole-6-carboxylate

has_obo_namespace

chebi_ontology

has_related_synonym

BIBF1120

nintedanib

BIBF 1120

BIBF-1120

id

CHEBI:85164

in_subset

http://purl.obolibrary.org/obo/chebi#3_STAR

inchi

InChI=1S/C31H33N5O4/c1-34-15-17-36(18-16-34)20-27(37)35(2)24-12-10-23(11-13-24)32-29(21-7-5-4-6-8-21)28-25-14-9-22(31(39)40-3)19-26(25)33-30(28)38/h4-14,19,32H,15-18,20H2,1-3H3,(H,33,38)/b29-28-

inchikey

XZXHXSATPCNXJR-ZIADKAODSA-N

is conjugate base of

http://purl.obolibrary.org/obo/CHEBI_85172

label

nintedanib

mass

539.62480

monoisotopicmass

539.25325

notation

CHEBI:85164

prefLabel

nintedanib

smiles

COC(=O)c1ccc2C(=C(\Nc3ccc(cc3)N(C)C(=O)CN3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1

treeView

http://purl.obolibrary.org/obo/CHEBI_62732

http://purl.obolibrary.org/obo/CHEBI_62733

http://purl.obolibrary.org/obo/CHEBI_46845

http://purl.obolibrary.org/obo/CHEBI_38459

http://purl.obolibrary.org/obo/CHEBI_33860

http://purl.obolibrary.org/obo/CHEBI_47989

http://purl.obolibrary.org/obo/CHEBI_25248

subClassOf

http://purl.obolibrary.org/obo/CHEBI_62732

http://purl.obolibrary.org/obo/CHEBI_62733

http://purl.obolibrary.org/obo/CHEBI_46845

http://purl.obolibrary.org/obo/CHEBI_38459

http://purl.obolibrary.org/obo/CHEBI_33860

http://purl.obolibrary.org/obo/CHEBI_47989

http://purl.obolibrary.org/obo/CHEBI_25248

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Delete Mapping To Ontology Source
http://purl.bioontology.org/ontology/UATC/L01XE31 ATC LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#C530716 RH-MESH LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C62765 NCIT LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C62765 NCIT LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C62765 NCIT LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C62765 NCIT LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C62765 NCIT LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C62765 NCIT LOOM
http://purl.bioontology.org/ontology/SNOMEDCT/715613009 SNOMEDCT LOOM
http://purl.bioontology.org/ontology/NDDF/015720 NDDF LOOM
http://purl.obolibrary.org/obo/CHEBI_85164 NBO LOOM
http://purl.obolibrary.org/obo/CHEBI_85164 NBO SAME_URI
http://stirdf.jst.go.jp/id/201007043893110846 IOBC LOOM
http://purl.bioontology.org/ontology/RXNORM/1592737 RXNORM LOOM
http://purl.jp/bio/4/id/201506013590380082 IOBC LOOM
http://purl.jp/bio/4/id/201506013590380082 IOBC LOOM
http://purl.bioontology.org/ontology/NDFRT/N0000191096 NDFRT LOOM
http://purl.bioontology.org/ontology/SNOMEDCT/712494002 SNOMEDCT LOOM
http://purl.obolibrary.org/obo/DRON_00730840 DRON LOOM
http://purl.bioontology.org/ontology/VANDF/4033814 VANDF LOOM
http://purl.bioontology.org/ontology/MESH/C530716 MESH LOOM