Compile Data Set for Download or QSAR
Report error Found 199 Enz. Inhib. hit(s) with all data for entry = 50016396
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50493145BDBM50493145(CHEMBL2419149)
Affinity DataKi:  0.00420nMAssay Description:Binding affinity to human adenosine A2A receptor expressed in HEK293T cells measured by radioligand binding assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A1(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50594655BDBM50594655(CHEMBL5177144)
Affinity DataKi:  0.0510nMAssay Description:Binding affinity to human adenosine A1A receptor measured by radioligand-based affinity assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A1(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50594654BDBM50594654(CHEMBL5171044)
Affinity DataKi:  0.0760nMAssay Description:Binding affinity to human adenosine A1A receptor measured by radioligand-based affinity assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50235055BDBM50235055(CHEMBL4095355)
Affinity DataKi:  0.200nMAssay Description:Antagonist activity at recombinant human adenosine A2A receptor expressed in HEK293 cells measured by cAMP functional assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50235053BDBM50235053(CHEMBL4064207)
Affinity DataKi:  0.25nMAssay Description:Antagonist activity at recombinant human adenosine A2A receptor expressed in HEK293 cells measured by cAMP functional assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A1(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50231590BDBM50231590(CHEMBL4063997)
Affinity DataKi:  0.280nMAssay Description:Antagonist activity at human adenosine A1A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50594659BDBM50594659(CHEMBL5182249)
Affinity DataKi:  0.400nMAssay Description:Displacement of [3H]ZM-241385 from human adenosine A2A receptor expressed in HEK293 cells incubated for 60 mins and measured by by scintillation coun...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A3(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50348176BDBM50348176(CHEMBL1562432)
Affinity DataKi:  0.441nMAssay Description:Antagonist activity at adenosine A3 receptor (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50202986BDBM50202986(SCH-420814 | 7-(2-(4-(2,4-difluorophenyl)piperazin...)
Affinity DataKi:  0.5nMAssay Description:Antagonist activity at adenosine A2A receptor (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50268232BDBM50268232(8-(4-(4-(4-Chlorophenyl)piperazine-1-sulfonyl)phen...)
Affinity DataKi:  0.553nMAssay Description:Antagonist activity at adenosine A2A receptor (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50018688BDBM50018688(CHEMBL3291301)
Affinity DataKi:  0.560nMAssay Description:Binding affinity to human adenosine A2A receptor measured by radioligand-based affinity assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A1(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50003019BDBM50003019(8-(Hexahydro-2,5-methano-pentalen-3a-yl)-1,3-dipro...)
Affinity DataKi:  0.700nMAssay Description:Antagonist activity at adenosine A1 receptor (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A1(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50550813BDBM50550813(CHEMBL1316674)
Affinity DataKi:  0.700nMAssay Description:Antagonist activity at adenosine A1 receptor (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2b(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50232044BDBM50232044(CHEMBL4083317)
Affinity DataKi:  0.900nMAssay Description:Antagonist activity at human adenosine A2B receptor expressed in HEK293 cells assessed as inhibition of cAMP productionMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50235052BDBM50235052(CHEMBL4099688)
Affinity DataKi:  1.10nMAssay Description:Antagonist activity at recombinant human adenosine A2A receptor expressed in HEK293 cells measured by cAMP functional assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A3(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50470471BDBM50470471(CHEMBL4294479)
Affinity DataKi:  1.20nMAssay Description:Binding affinity to human adenosine A3A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50254013BDBM50254013(3-(4-Amino-3-methylbenzyl)-7-(2-furyl)-3H-[1,2,3]t...)
Affinity DataKi:  1.30nMAssay Description:Antagonist activity at adenosine A2A receptor (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50594660BDBM50594660(CHEMBL5203657)
Affinity DataKi:  1.5nMAssay Description:Binding affinity to human adenosine A2A receptor expressed in HEK293 cells measured by radioligand based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 21190BDBM21190(CHEMBL113142 | 4-(2-{[5-amino-2-(furan-2-yl)-[1,2,...)
Affinity DataIC50: 1.5nMAssay Description:Inverse agonist activity at human A2A receptor assessed as inhibition of cAMP accumulationMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50594625BDBM50594625(Etrumadenant | Ab-928 | Ab928 | AB-928 | AB928 | E...)
Affinity DataKi:  1.5nMAssay Description:Antagonist activity at adenosine A2A receptor (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50594634BDBM50594634(CHEMBL5182250)
Affinity DataIC50: 1.60nMAssay Description:Inverse agonist activity at human A2A receptor assessed as inhibition of basal cAMP levelMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 21190BDBM21190(CHEMBL113142 | 4-(2-{[5-amino-2-(furan-2-yl)-[1,2,...)
Affinity DataKi:  1.60nMAssay Description:Antagonist activity at adenosine A2A receptor (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 493757BDBM493757(US10988455, Example 1(xcv))
Affinity DataKi:  1.70nMAssay Description:Antagonist activity at adenosine A2A receptor (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50211087BDBM50211087(CHEMBL3958838)
Affinity DataIC50: 1.90nMAssay Description:Inverse agonist activity at human A2A receptor assessed as inhibition of cAMP accumulationMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A1(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50231596BDBM50231596(CHEMBL4074150)
Affinity DataKi:  2nMAssay Description:Antagonist activity at human adenosine A1A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A1(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50231588BDBM50231588(CHEMBL4084453)
Affinity DataKi:  2nMAssay Description:Antagonist activity at human adenosine A1A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A1(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50231597BDBM50231597(CHEMBL4102409)
Affinity DataKi:  2nMAssay Description:Antagonist activity at human adenosine A1A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50086170BDBM50086170(CHEMBL1628266 | N-(4-Cyano-phenyl)-2-[4-(2,6-dioxo...)
Affinity DataKi:  2nMAssay Description:Antagonist activity at adenosine A2A receptor (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50235055BDBM50235055(CHEMBL4095355)
Affinity DataKi:  2.10nMAssay Description:Binding affinity to human adenosine A2A receptor expressed in HEK293 cells measured by radioligand based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A1(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50594652BDBM50594652(CHEMBL5184412)
Affinity DataKi:  2.20nMAssay Description:Binding affinity to human adenosine A1A receptor expressed in CHO cells measured by radioligand binding assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A3(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50348174BDBM50348174(CHEMBL1625681)
Affinity DataKi:  2.30nMAssay Description:Antagonist activity at adenosine A3 receptor (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50563125BDBM50563125(CHEMBL4742132)
Affinity DataKi:  2.40nMAssay Description:Binding affinity to human adenosine A2A receptor measured by radioligand-based affinity assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A3(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50427598BDBM50427598(CHEMBL2322924)
Affinity DataKi:  2.40nMAssay Description:Binding affinity to human adenosine A3A receptor measured by radioligand-based affinity assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50238381BDBM50238381(CHEMBL4064795)
Affinity DataKi:  2.90nMAssay Description:Binding affinity to human adenosine A2A receptor measured by radioligand-based affinity assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50491090BDBM50491090(CHEMBL2377109)
Affinity DataKi:  2.90nMAssay Description:Binding affinity to human adenosine A2A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50011294BDBM50011294(Ro-4494351-002 | Ro-4494351 | SYN-115 | Ro-4494351...)
Affinity DataKi:  3.40nMAssay Description:Binding affinity to human adenosine A2A receptor measured by radioligand-based affinity assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50553404BDBM50553404(Ciforadenant | V81444 | CPI-444 | V-81444)
Affinity DataKi:  3.40nMAssay Description:Antagonist activity at adenosine A2A receptor (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50235048BDBM50235048(CHEMBL4080594)
Affinity DataKi:  3.40nMAssay Description:Antagonist activity at recombinant human adenosine A2A receptor expressed in HEK293 cells measured by cAMP functional assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50211087BDBM50211087(CHEMBL3958838)
Affinity DataKi:  3.60nMAssay Description:Binding affinity to human adenosine A2A receptor measured by radioligand-based affinity assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50491075BDBM50491075(CHEMBL2377111)
Affinity DataKi:  3.70nMAssay Description:Binding affinity to human adenosine A2A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50491105BDBM50491105(CHEMBL2377110)
Affinity DataKi:  3.70nMAssay Description:Binding affinity to human adenosine A2A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50594632BDBM50594632(CHEMBL5181385)
Affinity DataKi:  3.70nMAssay Description:Binding affinity to human adenosine A2A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A1(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50594651BDBM50594651(CHEMBL5200283)
Affinity DataKi:  3.80nMAssay Description:Binding affinity to human adenosine A1A receptor expressed in CHO cells measured by radioligand binding assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2b(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50232049BDBM50232049(CHEMBL4095843)
Affinity DataKi:  4nMAssay Description:Antagonist activity at human adenosine A2B receptor expressed in HEK293 cells assessed as inhibition of cAMP productionMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A3(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50550824BDBM50550824(CHEMBL4797181)
Affinity DataKi:  4.60nMAssay Description:Binding affinity to human adenosine A3A receptor measured by radioligand-based affinity assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50594633BDBM50594633(CHEMBL5205474)
Affinity DataKi:  4.60nMAssay Description:Binding affinity to human adenosine A2A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50275599BDBM50275599(CHEMBL4127213)
Affinity DataKi:  4.70nMAssay Description:Binding affinity to human adenosine A2A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A1(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50594632BDBM50594632(CHEMBL5181385)
Affinity DataKi:  4.70nMAssay Description:Binding affinity to human adenosine A1 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50011294BDBM50011294(Ro-4494351-002 | Ro-4494351 | SYN-115 | Ro-4494351...)
Affinity DataKi:  5nMAssay Description:Antagonist activity at adenosine A2A receptor (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetAdenosine receptor A2a(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50211078BDBM50211078(CHEMBL3904408)
Affinity DataKi:  5.30nMAssay Description:Binding affinity to human adenosine A2A receptor measured by radioligand-based affinity assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
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