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BDBM50435498 CHEMBL2392239

SMILES: C(Nc1ccnc(n1)-c1ccc2OCOc2c1)c1cnc2ccccc2c1

InChI Key: InChIKey=NRDOHGOYRQETBJ-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 = 50435498   
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
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (Human))
BDBM50435498
PNG
(CHEMBL2392239)
Show SMILES C(Nc1ccnc(n1)-c1ccc2OCOc2c1)c1cnc2ccccc2c1
Show InChI InChI=1S/C21H16N4O2/c1-2-4-17-15(3-1)9-14(11-23-17)12-24-20-7-8-22-21(25-20)16-5-6-18-19(10-16)27-13-26-18/h1-11H,12-13H2,(H,22,24,25)
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.92E+4n/an/an/an/an/an/a



University of Kansas Specialized Chemistry Center

Curated by ChEMBL


Assay Description
Inhibition of DYRK1A (unknown origin) by bioluminescence assay


Bioorg Med Chem Lett 23: 3654-61 (2013)


Article DOI: 10.1016/j.bmcl.2013.02.096
BindingDB Entry DOI: 10.7270/Q2M90B2B
More data for this
Ligand-Target Pair
Dual specificity protein kinase CLK4


(Homo sapiens (Human))
BDBM50435498
PNG
(CHEMBL2392239)
Show SMILES C(Nc1ccnc(n1)-c1ccc2OCOc2c1)c1cnc2ccccc2c1
Show InChI InChI=1S/C21H16N4O2/c1-2-4-17-15(3-1)9-14(11-23-17)12-24-20-7-8-22-21(25-20)16-5-6-18-19(10-16)27-13-26-18/h1-11H,12-13H2,(H,22,24,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4.12E+4n/an/an/an/an/an/a



University of Kansas Specialized Chemistry Center

Curated by ChEMBL


Assay Description
Inhibition of CLK4 (unknown origin) by bioluminescence assay


Bioorg Med Chem Lett 23: 3654-61 (2013)


Article DOI: 10.1016/j.bmcl.2013.02.096
BindingDB Entry DOI: 10.7270/Q2M90B2B
More data for this
Ligand-Target Pair