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BDBM50444111 CHEMBL3093164

SMILES: Nc1ncc(cc1-c1nc2ccc(Oc3ccc(nn3)-c3ccccc3)cc2o1)-c1cnn(c1)C1CCNCC1

InChI Key: InChIKey=KZBLGKXJZXZAEJ-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50444111   
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-adrenergic receptor kinase 1


(Homo sapiens (Human))
BDBM50444111
PNG
(CHEMBL3093164)
Show SMILES Nc1ncc(cc1-c1nc2ccc(Oc3ccc(nn3)-c3ccccc3)cc2o1)-c1cnn(c1)C1CCNCC1
Show InChI InChI=1S/C30H26N8O2/c31-29-24(14-20(16-33-29)21-17-34-38(18-21)22-10-12-32-13-11-22)30-35-26-7-6-23(15-27(26)40-30)39-28-9-8-25(36-37-28)19-4-2-1-3-5-19/h1-9,14-18,22,32H,10-13H2,(H2,31,33)
PDB
MMDB

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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 3.80E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibition of GRK-2 (unknown origin) preincubated with enzyme for 10 mins before adding peptide substrate and ATP measured after 1 hr by LANCE-TR-FRE...


Bioorg Med Chem Lett 23: 6711-6 (2013)


Article DOI: 10.1016/j.bmcl.2013.10.036
BindingDB Entry DOI: 10.7270/Q2SX6FPP
More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 5


(Homo sapiens (Human))
BDBM50444111
PNG
(CHEMBL3093164)
Show SMILES Nc1ncc(cc1-c1nc2ccc(Oc3ccc(nn3)-c3ccccc3)cc2o1)-c1cnn(c1)C1CCNCC1
Show InChI InChI=1S/C30H26N8O2/c31-29-24(14-20(16-33-29)21-17-34-38(18-21)22-10-12-32-13-11-22)30-35-26-7-6-23(15-27(26)40-30)39-28-9-8-25(36-37-28)19-4-2-1-3-5-19/h1-9,14-18,22,32H,10-13H2,(H2,31,33)
PDB

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UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.20E+3n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibition of GRK-5 (unknown origin) preincubated with enzyme for 10 mins before adding peptide substrate and ATP measured after 1 hr by LANCE-TR-FRE...


Bioorg Med Chem Lett 23: 6711-6 (2013)


Article DOI: 10.1016/j.bmcl.2013.10.036
BindingDB Entry DOI: 10.7270/Q2SX6FPP
More data for this
Ligand-Target Pair