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PubMed code 12014953

Compile data set for download or QSAR
Found 3 hits of Enzyme Inhibition Constant Data   
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
Beta-adrenergic receptor kinase 1


(Homo sapiens (Human))
BDBM50113255
PNG
(5-[2-(5-Nitro-furan-2-yl)-vinyl]-furan-2-carboxyli...)
Show SMILES COC(=O)c1ccc(\C=C\c2ccc(o2)[N+]([O-])=O)o1
Show InChI InChI=1S/C12H9NO6/c1-17-12(14)10-6-4-8(18-10)2-3-9-5-7-11(19-9)13(15)16/h2-7H,1H3/b3-2+
PDB
MMDB

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CHEMBL
MCE
PC cid
PC sid
UniChem
PubMed
n/an/a 1.26E+5n/an/an/an/an/an/a



Daiichi Pharmaceutical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibition of Beta-adrenergic receptor kinase 1


J Med Chem 45: 2150-9 (2002)


BindingDB Entry DOI: 10.7270/Q2Q81CCR
More data for this
Ligand-Target Pair
Beta-adrenergic receptor kinase 1


(Homo sapiens (Human))
BDBM50113256
PNG
(2-[5-Amino-3-(3,4-dihydroxy-5-hydroxymethyl-tetrah...)
Show SMILES NC(=O)Cc1c(N)ncn1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C10H16N4O5/c11-6(16)1-4-9(12)13-3-14(4)10-8(18)7(17)5(2-15)19-10/h3,5,7-8,10,15,17-18H,1-2,12H2,(H2,11,16)/t5-,7-,8-,10-/m1/s1
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PC cid
PC sid
UniChem
PubMed
n/an/a 5.57E+5n/an/an/an/an/an/a



Daiichi Pharmaceutical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibition of Beta-adrenergic receptor kinase 1


J Med Chem 45: 2150-9 (2002)


BindingDB Entry DOI: 10.7270/Q2Q81CCR
More data for this
Ligand-Target Pair
Beta-adrenergic receptor kinase 1


(Homo sapiens (Human))
BDBM50113257
PNG
(3-tert-Butyl-2-propionyl-2H-indeno[1,2-c]pyrazol-4...)
Show SMILES CCC(=O)n1nc2-c3ccccc3C(=O)c2c1C(C)(C)C
Show InChI InChI=1S/C17H18N2O2/c1-5-12(20)19-16(17(2,3)4)13-14(18-19)10-8-6-7-9-11(10)15(13)21/h6-9H,5H2,1-4H3
PDB
MMDB

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CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 5.63E+5n/an/an/an/an/an/a



Daiichi Pharmaceutical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibition of Beta-adrenergic receptor kinase 1


J Med Chem 45: 2150-9 (2002)


BindingDB Entry DOI: 10.7270/Q2Q81CCR
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%