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BDBM50344815 CHEMBL1779918::N-(4-hydroxy-2,6-dimethylphenyl)-5-(3-methylthiophen-2-yl)furan-2-carboxamide

SMILES: Cc1ccsc1-c1ccc(o1)C(=O)Nc1c(C)cc(O)cc1C

InChI Key: InChIKey=YWCCBTJTYOFZIF-UHFFFAOYSA-N

Data: 1 IC50

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50344815   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Sphingosine 1-phosphate receptor 4


(Homo sapiens (Human))
BDBM50344815
PNG
(CHEMBL1779918 | N-(4-hydroxy-2,6-dimethylphenyl)-5...)
Show SMILES Cc1ccsc1-c1ccc(o1)C(=O)Nc1c(C)cc(O)cc1C
Show InChI InChI=1S/C18H17NO3S/c1-10-6-7-23-17(10)14-4-5-15(22-14)18(21)19-16-11(2)8-13(20)9-12(16)3/h4-9,20H,1-3H3,(H,19,21)
NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 46n/an/an/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at S1P4 receptor in human U2OS cells expressing EDG6-linked GAL4-VP16 transcription factor via TEV protease site/beta-arrestin/TE...


Bioorg Med Chem Lett 21: 3632-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.04.097
BindingDB Entry DOI: 10.7270/Q2T1540Z
More data for this
Ligand-Target Pair