null

SMILES CCn1cc2c(n1)nc(NC(=O)Nc1cccc(Cl)c1)n1nc(nc21)-c1ccco1

InChI Key InChIKey=NWAXVCISHHAARQ-UHFFFAOYSA-N

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 22 hits for monomerid = 50082425   

TargetAdenosine receptor A3(Homo sapiens (Human))
National University of Singapore

Curated by ChEMBL
LigandPNGBDBM50082425(1-(3-Chloro-phenyl)-3-(8-ethyl-2-furan-2-yl-8H-pyr...)copy SMILEScopy InChI
Affinity DataKi:  1.60nMAssay Description:Antagonist activity at human adenosine A3 receptorMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2VH5P5ZPubMed
TargetAdenosine receptor A3(Homo sapiens (Human))
National University of Singapore

Curated by ChEMBL
LigandPNGBDBM50082425(1-(3-Chloro-phenyl)-3-(8-ethyl-2-furan-2-yl-8H-pyr...)copy SMILEScopy InChI
Affinity DataKi:  1.60nMAssay Description:Binding affinity to human adenosine A3 receptorMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q22Z18GV
TargetAdenosine receptor A3(Homo sapiens (Human))
National University of Singapore

Curated by ChEMBL
LigandPNGBDBM50082425(1-(3-Chloro-phenyl)-3-(8-ethyl-2-furan-2-yl-8H-pyr...)copy SMILEScopy InChI
Affinity DataKi:  1.60nMAssay Description:Binding affinity for human adenosine A3 receptorMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2183609PubMed
TargetAdenosine receptor A3(Homo sapiens (Human))
National University of Singapore

Curated by ChEMBL
LigandPNGBDBM50082425(1-(3-Chloro-phenyl)-3-(8-ethyl-2-furan-2-yl-8H-pyr...)copy SMILEScopy InChI
Affinity DataKi:  1.60nMAssay Description:Displacement of [3H]-MRE3008-F20 from human Adenosine A3 receptor expressed in HEK cells; range 1.42-1.79More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q27W6BHWPubMed
TargetAdenosine receptor A3(Homo sapiens (Human))
National University of Singapore

Curated by ChEMBL
LigandPNGBDBM50082425(1-(3-Chloro-phenyl)-3-(8-ethyl-2-furan-2-yl-8H-pyr...)copy SMILEScopy InChI
Affinity DataKi:  1.60nMAssay Description:Displacement of [3H]-MRE3008-F20 from human adenosine A3 receptor expressed in CHO cells; range 1.42-1.79More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2D21WWTPubMed
TargetAdenosine receptor A3(Homo sapiens (Human))
National University of Singapore

Curated by ChEMBL
LigandPNGBDBM50082425(1-(3-Chloro-phenyl)-3-(8-ethyl-2-furan-2-yl-8H-pyr...)copy SMILEScopy InChI
Affinity DataKi:  1.60nMAssay Description:Displacement of [3H]NECA from human adenosine A3 receptor expressed in CHO cellsChecked by AuthorMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q23N23FXPubMed
TargetAdenosine receptor A3(Homo sapiens (Human))
National University of Singapore

Curated by ChEMBL
LigandPNGBDBM50082425(1-(3-Chloro-phenyl)-3-(8-ethyl-2-furan-2-yl-8H-pyr...)copy SMILEScopy InChI
Affinity DataKi:  2.10nMAssay Description:Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2KK9BC7PubMed
TargetAdenosine receptor A3(Homo sapiens (Human))
National University of Singapore

Curated by ChEMBL
LigandPNGBDBM50082425(1-(3-Chloro-phenyl)-3-(8-ethyl-2-furan-2-yl-8H-pyr...)copy SMILEScopy InChI
Affinity DataKi:  2.10nMAssay Description:Displacement of [125]AB-MECA from human Adenosine A3 receptor expressed in HEK-293 cellsMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q26972RXPubMed
TargetAdenosine receptor A2b(Homo sapiens (Human))
Università degli Studi di Ferrara

Curated by ChEMBL
LigandPNGBDBM50082425(1-(3-Chloro-phenyl)-3-(8-ethyl-2-furan-2-yl-8H-pyr...)copy SMILEScopy InChI
Affinity DataKi:  150nMAssay Description:Displacement of [3H]-DPCPX from Adenosine A2b receptor expressed in CHO cells; range 107-210More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2D21WWTPubMed
TargetAdenosine receptor A2b(Homo sapiens (Human))
Università degli Studi di Ferrara

Curated by ChEMBL
LigandPNGBDBM50082425(1-(3-Chloro-phenyl)-3-(8-ethyl-2-furan-2-yl-8H-pyr...)copy SMILEScopy InChI
Affinity DataKi:  150nMAssay Description:Displacement of [3H]-DPCPX from human Adenosine A2B receptor expressed in HEK-293 cells; range 107-210More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q27W6BHWPubMed
TargetAdenosine receptor A2a(Homo sapiens (Human))
Universit£ di Padova

Curated by ChEMBL
LigandPNGBDBM50082425(1-(3-Chloro-phenyl)-3-(8-ethyl-2-furan-2-yl-8H-pyr...)copy SMILEScopy InChI
Affinity DataKi:  180nMAssay Description:Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cellsChecked by AuthorMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q23N23FXPubMed
TargetAdenosine receptor A2a(Homo sapiens (Human))
Universit£ di Padova

Curated by ChEMBL
LigandPNGBDBM50082425(1-(3-Chloro-phenyl)-3-(8-ethyl-2-furan-2-yl-8H-pyr...)copy SMILEScopy InChI
Affinity DataKi:  180nMAssay Description:Displacement of [3H]-SCH-58,261 from human Adenosine A2A receptor expressed in HEK-293 cells; range 160-210More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q27W6BHWPubMed
TargetAdenosine receptor A2a(Homo sapiens (Human))
Universit£ di Padova

Curated by ChEMBL
LigandPNGBDBM50082425(1-(3-Chloro-phenyl)-3-(8-ethyl-2-furan-2-yl-8H-pyr...)copy SMILEScopy InChI
Affinity DataKi:  180nMAssay Description:Displacement of [3H]-SCH- 58261 from human adenosine A2A receptor expressed in CHO cells; range 160-210More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2D21WWTPubMed
TargetAdenosine receptor A2a(Homo sapiens (Human))
Universit£ di Padova

Curated by ChEMBL
LigandPNGBDBM50082425(1-(3-Chloro-phenyl)-3-(8-ethyl-2-furan-2-yl-8H-pyr...)copy SMILEScopy InChI
Affinity DataKi:  185nMAssay Description:Displacement of specific [3H]-SCH- 58261 binding at human Adenosine A2A receptor expressed in HEK-293 cellsMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q26972RXPubMed
TargetAdenosine receptor A1(Homo sapiens (Human))
Università degli Studi di Ferrara

Curated by ChEMBL
LigandPNGBDBM50082425(1-(3-Chloro-phenyl)-3-(8-ethyl-2-furan-2-yl-8H-pyr...)copy SMILEScopy InChI
Affinity DataKi:  249nMAssay Description:Displacement of [3H]-DPCPX from human adenosine A1 receptor expressed in CHO cells; range 215-289More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2D21WWTPubMed
TargetAdenosine receptor A1(Homo sapiens (Human))
Università degli Studi di Ferrara

Curated by ChEMBL
LigandPNGBDBM50082425(1-(3-Chloro-phenyl)-3-(8-ethyl-2-furan-2-yl-8H-pyr...)copy SMILEScopy InChI
Affinity DataKi:  249nMAssay Description:Displacement of [3H]-DPCPX from human Adenosine A1 receptor expressed in CHO cells; range 215-289More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q27W6BHWPubMed
TargetAdenosine receptor A1(Homo sapiens (Human))
Università degli Studi di Ferrara

Curated by ChEMBL
LigandPNGBDBM50082425(1-(3-Chloro-phenyl)-3-(8-ethyl-2-furan-2-yl-8H-pyr...)copy SMILEScopy InChI
Affinity DataKi:  249nMAssay Description:Displacement of [3H]-DPCPX from human Adenosine A1 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q26972RXPubMed
TargetAdenosine receptor A3(Homo sapiens (Human))
National University of Singapore

Curated by ChEMBL
LigandPNGBDBM50082425(1-(3-Chloro-phenyl)-3-(8-ethyl-2-furan-2-yl-8H-pyr...)copy SMILEScopy InChI
Affinity DataKi:  912nMAssay Description:Displacement of [3H]MRE3008-F20 from human adenosine A3 receptor expressed in CHO cells after 120 minsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XP766QPubMed
TargetAdenosine receptor A1(Rattus norvegicus (rat))
Università degli Studi di Ferrara

Curated by ChEMBL
LigandPNGBDBM50082425(1-(3-Chloro-phenyl)-3-(8-ethyl-2-furan-2-yl-8H-pyr...)copy SMILEScopy InChI
Affinity DataKi:  2.70E+3nMAssay Description:Displacement of [3H]-DPCPX from Adenosine A1 receptor of rat brain membranesMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q26972RXPubMed
TargetAdenosine receptor A2a(Rattus norvegicus (rat))
Università degli Studi di Ferrara

Curated by ChEMBL
LigandPNGBDBM50082425(1-(3-Chloro-phenyl)-3-(8-ethyl-2-furan-2-yl-8H-pyr...)copy SMILEScopy InChI
Affinity DataKi:  2.80E+3nMAssay Description:Displacement of [3H]-SCH- 58261 from Adenosine A2A receptor in rat striatal membranesMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q26972RXPubMed
TargetAdenosine receptor A3(Homo sapiens (Human))
National University of Singapore

Curated by ChEMBL
LigandPNGBDBM50082425(1-(3-Chloro-phenyl)-3-(8-ethyl-2-furan-2-yl-8H-pyr...)copy SMILEScopy InChI
Affinity DataIC50: 14.8nMAssay Description:Inhibition of cAMP accumulation in CHO cells expressing human adenosine A3 receptor; range 10.8-21.5More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2D21WWTPubMed
TargetAdenosine receptor A3(Homo sapiens (Human))
National University of Singapore

Curated by ChEMBL
LigandPNGBDBM50082425(1-(3-Chloro-phenyl)-3-(8-ethyl-2-furan-2-yl-8H-pyr...)copy SMILEScopy InChI
Affinity DataIC50: 15nMAssay Description:Inhibitory concentration as antagonistic activity against cAMP generation inhibited by IB-MECA in CHO cell membranes transfected with human Adenosine...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q26972RXPubMed