BDBM50075884 4-(4-Hexyl-5-oxo-4,5-dihydro-[1,2,4]triazol-1-yl)-N-{4-[2-((R)-2-hydroxy-2-pyridin-3-yl-ethylamino)-ethyl]-phenyl}-benzenesulfonamide::4-(4-Hexyl-5-oxo-4,5-dihydro-[1,2,4]triazol-1-yl)-N-{4-[2-(2-hydroxy-2-pyridin-3-yl-ethylamino)-ethyl]-phenyl}-benzenesulfonamide::CHEMBL79806

SMILES CCCCCCn1cnn(-c2ccc(cc2)S(=O)(=O)Nc2ccc(CCNC[C@H](O)c3cccnc3)cc2)c1=O

InChI Key InChIKey=HONYGDGBHSDJFC-UHFFFAOYSA-N

Data  2 IC50  3 EC50

  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 5 hits for monomerid = 50075884   

TargetBeta-2 adrenergic receptor(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50075884(4-(4-Hexyl-5-oxo-4,5-dihydro-[1,2,4]triazol-1-yl)-...)
Affinity DataIC50: 4.50E+3nMAssay Description:Binding affinity towards Beta-2 adrenergic receptor in CHO cells expressing the cloned human receptor using 125I]iodocyanopindololMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetBeta-3 adrenergic receptor(Human)
Central Drug Research Institute

Curated by ChEMBL
LigandPNGBDBM50075884(4-(4-Hexyl-5-oxo-4,5-dihydro-[1,2,4]triazol-1-yl)-...)
Affinity DataEC50:  1.66E+8nMAssay Description:In vitro effective concentration against beta-3 adrenergic receptor.More data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetBeta-3 adrenergic receptor(Human)
Central Drug Research Institute

Curated by ChEMBL
LigandPNGBDBM50075884(4-(4-Hexyl-5-oxo-4,5-dihydro-[1,2,4]triazol-1-yl)-...)
Affinity DataEC50:  6nMAssay Description:Agonist activity towards Beta-3 adrenergic receptorMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetBeta-1 adrenergic receptor(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50075884(4-(4-Hexyl-5-oxo-4,5-dihydro-[1,2,4]triazol-1-yl)-...)
Affinity DataIC50: 8.50E+3nMAssay Description:Binding affinity towards Beta-1 adrenergic receptor in CHO cells expressing the cloned human receptor using 125I]iodocyanopindololMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetBeta-3 adrenergic receptor(Human)
Central Drug Research Institute

Curated by ChEMBL
LigandPNGBDBM50075884(4-(4-Hexyl-5-oxo-4,5-dihydro-[1,2,4]triazol-1-yl)-...)
Affinity DataEC50:  6nMAssay Description:In vitro effective concentration against beta-3 adrenergic receptor.More data for this Ligand-Target Pair
In DepthDetails Article
PubMed