SPARQL
Query
Update
Search
Quick
Advanced
Co-occurrence
RelFinder
About
Sources
Admin
System Info
Repository Management
Search Configuration
Sources
13048
Source:
http://linkedlifedata.com/resource/chembl/compound/13048
Search
Subject
(
100
of
many
)
Predicate
Object
All
Download in:
JSON
RDF
N3/Turtle
N-Triples
Named Graph
All
UniProt
NCBIGene
DrugBank
ClinicalTrials
UMLS
PubMed
Mappings
MentionedEntities
Language
All
English
Español
Português
Français
Deutsch
Русский
日本語
Български
Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists as a subject.
Predicate
Object
rdf:type
chembl:ChemicalCompound
chemicalCompound:synonym
synonym:13048_Sunitinib_INN
,
synonym:13048_Sunitinib_OTHER
,
synonym:13048_Sutent_OTHER
,
synonym:13048_Sutent_TRADE_NAME
chemicalCompound:standardIn...
InChI=1S/C22H27FN4O2/c1-5-27(6-2)10-9-24-22(29)20-13(3)19(25-14(20)4)12-17-16-11-15(23)7-8-18(16)26-21(17)28/h7-8,11-12,25H,5-6,9-10H2,1-4H3,(H,24,29)(H,26,28)/b17-12-
chemicalCompound:standardIn...
WINHZLLDWRZWRT-ATVHPVEESA-N
chemicalCompound:canonicalS...
CCN(CC)CCNC(=O)c1c(C)[nH]c(\C=C\2/C(=O)Nc3ccc(F)cc23)c1C
chemicalCompound:molecularF...
C22H27FN4O2
chemicalCompound:moleculeId
13048
chemicalCompound:mwFreebase
398.474
chemicalCompound:alogp
2.997
chemicalCompound:hba
3
chemicalCompound:hbd
3
chemicalCompound:psa
77.23
chemicalCompound:rtb
7
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
0
chemicalCompound:medChemFri...
Y
chemicalCompound:acdMostApk...
11.701
chemicalCompound:acdLogP
2.267
chemicalCompound:acdLogD
0.437
chemicalCompound:molecularS...
molecularSpecies:BASE
chemicalCompound:fullMwt
398.474
chemicalCompound:acdMostBpk...
9.089
chemicalCompound:chemblId
CHEMBL535
chemicalCompound:maxPhase
4
chemicalCompound:therapeuti...
1
chemicalCompound:dosedIngre...
No
chemicalCompound:structureT...
structureType:MOL
chemicalCompound:chebi
https://linkedlifedata.com/resource/chebi/id/CHEBI:113048
chemicalCompound:moleculeTy...
moleculeType:Small molecule
chemicalCompound:oral
Yes
chemicalCompound:parenteral
No
chemicalCompound:topical
No
chemicalCompound:blackBoxWa...
No
chemicalCompound:naturalPro...
No
chemicalCompound:proDrug
No
chemicalCompound:prefName
SUNITINIB
chemicalCompound:chebiParen...
https://linkedlifedata.com/resource/chebi/id/CHEBI:38940
chemicalCompound:firstAppro...
2006
chemicalCompound:activity
activity:751792
,
activity:751793
,
activity:751794
,
activity:751795
,
activity:751796
,
activity:751797
,
activity:751798
,
activity:751799
,
activity:751800
,
activity:751801
,
activity:751802
,
activity:751803
,
activity:751804
,
activity:751805
,
activity:751806
,
activity:1650003
,
activity:1650012
,
activity:1650021
,
activity:1650030
,
activity:1650039
,
activity:1650048
,
activity:1650057
,
activity:1650066
,
activity:1650075
,
activity:1650084
,
activity:1650093
,
activity:1650102
,
activity:1650111
,
activity:1650120
,
activity:1650129
,
activity:1650138
,
activity:1650147
,
activity:1650156
,
activity:1650165
,
activity:1650174
,
activity:1650183
,
activity:1650192
,
activity:1650201
,
activity:1650210
,
activity:1650219
,
activity:1650228
,
activity:1650237
,
activity:1650246
,
activity:1650255
,
activity:1650264
,
activity:1650273
,
activity:1650282
,
activity:1650291
,
activity:1650300
,
activity:1650309
,
activity:1650318
,
activity:1650327
,
activity:1650336
,
activity:1650345
,
activity:1650354
,
activity:1650363
,
activity:1650372
,
activity:1650381
,
activity:1650390
More...