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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 323.3
BDBM521016

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 3 hits in this display   
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
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM521016
PNG
(US11149020, Compound 7 (MW-077))
Show SMILES C1CC1c1cc(-c2ccncc2)c(nn1)-c1cccc2ccccc12
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
186n/an/an/an/an/an/an/an/a


TBA

Assay Description
The concentration dependent ability of compounds to inhibit human p38α MAPK, p38β MAPK and CK-1δ were done essentially as described in...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2251NBP
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM521016
PNG
(US11149020, Compound 7 (MW-077))
Show SMILES C1CC1c1cc(-c2ccncc2)c(nn1)-c1cccc2ccccc12
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 419n/an/an/an/an/an/a


TBA

Assay Description
The concentration dependent ability of compounds to inhibit human p38α MAPK, p38β MAPK and CK-1δ were done essentially as described in...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2251NBP
More data for this
Ligand-Target Pair
Casein kinase I isoform delta


(Homo sapiens (Human))
BDBM521016
PNG
(US11149020, Compound 7 (MW-077))
Show SMILES C1CC1c1cc(-c2ccncc2)c(nn1)-c1cccc2ccccc12
PDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>1.00E+4n/an/an/an/an/an/a


TBA

Assay Description
The concentration dependent ability of compounds to inhibit human p38α MAPK, p38β MAPK and CK-1δ were done essentially as described in...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2251NBP
More data for this
Ligand-Target Pair