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BDBM223209 8-((6-Chloropyrimidin-4-yl)oxy)quinoline (Compound 1)

SMILES: Clc1cc(Oc2cccc3cccnc23)ncn1

InChI Key: InChIKey=JZDRSPLWHABZOI-UHFFFAOYSA-N

Data: 1 KI

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 223209   
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
Calcium/calmodulin- dependent protein kinase IV (CAMKIV)


(Homo sapiens (Human))
BDBM223209
PNG
(8-((6-Chloropyrimidin-4-yl)oxy)quinoline (Compound...)
Show SMILES Clc1cc(Oc2cccc3cccnc23)ncn1
Show InChI InChI=1S/C13H8ClN3O/c14-11-7-12(17-8-16-11)18-10-5-1-3-9-4-2-6-15-13(9)10/h1-8H
PDB

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PC cid
PC sid
UniChem
Article
PubMed
0.0109n/an/an/an/an/an/an/an/a



B.R. Ambedkar Bihar University



Assay Description
The docking and scoring of ligands with CAMKIV protein was accomplished using ParDOCK module of Sanjeevini drug design suite, which is based on physi...


Chem Biol Drug Des 89: 741-754 (2017)


Article DOI: 10.1111/cbdd.12898
BindingDB Entry DOI: 10.7270/Q28C9V30
More data for this
Ligand-Target Pair