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BDBM50054672 2-Furan-3-yl-6-methyl-4-((E)-styryl)-1,4-dihydro-pyridine-3,5-dicarboxylic acid diethyl ester::CHEMBL143019

SMILES: CCOC(=O)C1C(\C=C\c2ccccc2)C(C(=O)OCC)=C(N=C1C)c1ccoc1

InChI Key: InChIKey=IXFMPLDXVRMBSB-VAWYXSNFSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50054672   
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
Adenosine receptor A3


(Homo sapiens (Human))
BDBM50054672
PNG
(2-Furan-3-yl-6-methyl-4-((E)-styryl)-1,4-dihydro-p...)
Show SMILES CCOC(=O)C1C(\C=C\c2ccccc2)C(C(=O)OCC)=C(N=C1C)c1ccoc1 |c:21,23|
Show InChI InChI=1S/C24H25NO5/c1-4-29-23(26)20-16(3)25-22(18-13-14-28-15-18)21(24(27)30-5-2)19(20)12-11-17-9-7-6-8-10-17/h6-15,19-20H,4-5H2,1-3H3/b12-11+
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UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
907n/an/an/an/an/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Binding affinity against cloned human adenosine A3 receptor by radioligand binding assay using [125I]-AB-MECA.


J Med Chem 39: 4667-75 (1996)


Article DOI: 10.1021/jm960457c
BindingDB Entry DOI: 10.7270/Q2VQ33BG
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50054672
PNG
(2-Furan-3-yl-6-methyl-4-((E)-styryl)-1,4-dihydro-p...)
Show SMILES CCOC(=O)C1C(\C=C\c2ccccc2)C(C(=O)OCC)=C(N=C1C)c1ccoc1 |c:21,23|
Show InChI InChI=1S/C24H25NO5/c1-4-29-23(26)20-16(3)25-22(18-13-14-28-15-18)21(24(27)30-5-2)19(20)12-11-17-9-7-6-8-10-17/h6-15,19-20H,4-5H2,1-3H3/b12-11+
PDB

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KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
5.49E+3n/an/an/an/an/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Binding affinity against adenosine A1 receptor in rat cerebral cortex membrane by radioligand binding assay using [3H](R)-PIA.


J Med Chem 39: 4667-75 (1996)


Article DOI: 10.1021/jm960457c
BindingDB Entry DOI: 10.7270/Q2VQ33BG
More data for this
Ligand-Target Pair