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Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with all data for assayid = 9 entry = 50018160   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
G-protein coupled receptor 52


(Homo sapiens (Human))
BDBM50556715
PNG
(CHEMBL4782344)
Show SMILES O=C(\C=C\CCc1ccccc1)c1cccs1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
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MCE
PC cid
PC sid
UniChem
n/an/a 630n/an/an/an/an/an/a


TBA

Assay Description
In vitro inhibitory activity against beta-2 adrenergic receptor was measured by the inhibition of isoproterenol-induced relaxation of PGF2-alpha cont...


Citation and Details
More data for this
Ligand-Target Pair
G-protein coupled receptor 52


(Homo sapiens (Human))
BDBM50556698
PNG
(CHEMBL2375494)
Show SMILES O=C(\C=C\CCc1ccccc1)c1ccccc1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 650n/an/an/an/an/an/a


TBA

Assay Description
In vitro inhibitory activity against beta-2 adrenergic receptor was measured by the inhibition of isoproterenol-induced relaxation of PGF2-alpha cont...


Citation and Details
More data for this
Ligand-Target Pair
G-protein coupled receptor 52


(Homo sapiens (Human))
BDBM50556723
PNG
(CHEMBL240484)
Show SMILES O=C(CCc1ccccc1)\C=C\CCc1ccccc1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

MCE
PC cid
PC sid
UniChem
n/an/a 5.45E+3n/an/an/an/an/an/a


TBA

Assay Description
In vitro inhibitory activity against beta-2 adrenergic receptor was measured by the inhibition of isoproterenol-induced relaxation of PGF2-alpha cont...


Citation and Details
More data for this
Ligand-Target Pair
G-protein coupled receptor 52


(Homo sapiens (Human))
BDBM50405604
PNG
(CHEMBL5279049)
Show SMILES NC(=N)NCCC[C@H](OP(O)(=O)CCCCc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O
Show InChI InChI=1S/C21H33N4O6P/c22-21(23)24-13-6-12-18(19(26)25-14-7-11-17(25)20(27)28)31-32(29,30)15-5-4-10-16-8-2-1-3-9-16/h1-3,8-9,17-18H,4-7,10-15H2,(H,27,28)(H,29,30)(H4,22,23,24)/t17-,18-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

n/an/a 1.20E+4n/an/an/an/an/an/a


TBA

Assay Description
In vitro inhibitory activity against beta-2 adrenergic receptor was measured by the inhibition of isoproterenol-induced relaxation of PGF2-alpha cont...


Citation and Details
More data for this
Ligand-Target Pair