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SMILES: COc1ccc2nc(CNc3nc(nc4n(cnc34)-c3cccnc3)N3CCOCC3)[nH]c2c1

InChI Key: InChIKey=NCXXNDPQZABATO-UHFFFAOYSA-N

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 = 50454206   
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
Casein kinase I isoform delta


(Homo sapiens (Human))
BDBM50454206
PNG
(CHEMBL4213254)
Show SMILES COc1ccc2nc(CNc3nc(nc4n(cnc34)-c3cccnc3)N3CCOCC3)[nH]c2c1
Show InChI InChI=1S/C23H23N9O2/c1-33-16-4-5-17-18(11-16)28-19(27-17)13-25-21-20-22(30-23(29-21)31-7-9-34-10-8-31)32(14-26-20)15-3-2-6-24-12-15/h2-6,11-12,14H,7-10,13H2,1H3,(H,27,28)(H,25,29,30)
PDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 520n/an/an/an/an/an/a



Scripps Florida

Curated by ChEMBL


Assay Description
Inhibition of recombinant human full length N-terminal GST-tagged CK1delta expressed in baculovirus in Sf9 insect cells using ULight-Topo-IIa(Thr1342...


Bioorg Med Chem 26: 590-602 (2018)


Article DOI: 10.1016/j.bmc.2017.12.020
BindingDB Entry DOI: 10.7270/Q2RR21TZ
More data for this
Ligand-Target Pair
Casein kinase I isoform epsilon


(Homo sapiens (Human))
BDBM50454206
PNG
(CHEMBL4213254)
Show SMILES COc1ccc2nc(CNc3nc(nc4n(cnc34)-c3cccnc3)N3CCOCC3)[nH]c2c1
Show InChI InChI=1S/C23H23N9O2/c1-33-16-4-5-17-18(11-16)28-19(27-17)13-25-21-20-22(30-23(29-21)31-7-9-34-10-8-31)32(14-26-20)15-3-2-6-24-12-15/h2-6,11-12,14H,7-10,13H2,1H3,(H,27,28)(H,25,29,30)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 975n/an/an/an/an/an/a



Scripps Florida

Curated by ChEMBL


Assay Description
Inhibition of recombinant human full length N-terminal GST-tagged CK1epsilon expressed in baculovirus in Sf9 insect cells using ULight-Topo-IIa(Thr13...


Bioorg Med Chem 26: 590-602 (2018)


Article DOI: 10.1016/j.bmc.2017.12.020
BindingDB Entry DOI: 10.7270/Q2RR21TZ
More data for this
Ligand-Target Pair