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BDBM50078801 1-(5-hexyl-1,2,4-oxadiazol-3-yl)-N-phenyl-2,3-dihydro-1H-indole-5-sulfonamide::CHEMBL56768

SMILES: CCCCCCc1nc(no1)N1CCc2cc(ccc12)S(=O)(=O)Nc1ccccc1

InChI Key: InChIKey=SSPHDGKJKYUCEM-UHFFFAOYSA-N

Data: 2 IC50  1 EC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50078801   
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
Beta-2 adrenergic receptor


(Homo sapiens (Human))
BDBM50078801
PNG
(1-(5-hexyl-1,2,4-oxadiazol-3-yl)-N-phenyl-2,3-dihy...)
Show SMILES CCCCCCc1nc(no1)N1CCc2cc(ccc12)S(=O)(=O)Nc1ccccc1
Show InChI InChI=1S/C22H26N4O3S/c1-2-3-4-8-11-21-23-22(24-29-21)26-15-14-17-16-19(12-13-20(17)26)30(27,28)25-18-9-6-5-7-10-18/h5-7,9-10,12-13,16,25H,2-4,8,11,14-15H2,1H3
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PC cid
PC sid
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Similars

PubMed
n/an/a 52n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity towards cloned human beta-2 adrenergic receptor using [125I]-iodocyanopindolol as radioligand to stimulate increase in cAMP...


Bioorg Med Chem Lett 9: 1869-74 (1999)


BindingDB Entry DOI: 10.7270/Q2FN15D1
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Homo sapiens (Human))
BDBM50078801
PNG
(1-(5-hexyl-1,2,4-oxadiazol-3-yl)-N-phenyl-2,3-dihy...)
Show SMILES CCCCCCc1nc(no1)N1CCc2cc(ccc12)S(=O)(=O)Nc1ccccc1
Show InChI InChI=1S/C22H26N4O3S/c1-2-3-4-8-11-21-23-22(24-29-21)26-15-14-17-16-19(12-13-20(17)26)30(27,28)25-18-9-6-5-7-10-18/h5-7,9-10,12-13,16,25H,2-4,8,11,14-15H2,1H3
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PC sid
UniChem

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PubMed
n/an/a 600n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity towards cloned human beta-1 adrenergic receptor using [125I]-iodocyanopindolol as radioligand to stimulate increase in cAMP...


Bioorg Med Chem Lett 9: 1869-74 (1999)


BindingDB Entry DOI: 10.7270/Q2FN15D1
More data for this
Ligand-Target Pair
Beta-3 adrenergic receptor


(Homo sapiens (Human))
BDBM50078801
PNG
(1-(5-hexyl-1,2,4-oxadiazol-3-yl)-N-phenyl-2,3-dihy...)
Show SMILES CCCCCCc1nc(no1)N1CCc2cc(ccc12)S(=O)(=O)Nc1ccccc1
Show InChI InChI=1S/C22H26N4O3S/c1-2-3-4-8-11-21-23-22(24-29-21)26-15-14-17-16-19(12-13-20(17)26)30(27,28)25-18-9-6-5-7-10-18/h5-7,9-10,12-13,16,25H,2-4,8,11,14-15H2,1H3
PDB

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UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/an/an/a 13n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro agonistic activity against cloned human beta-3 adrenergic receptor using [125I]-iodocyanopindolol as radioligand to stimulate increase in cA...


Bioorg Med Chem Lett 9: 1869-74 (1999)


BindingDB Entry DOI: 10.7270/Q2FN15D1
More data for this
Ligand-Target Pair