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BDBM50176581 5-methyl-4-(4-phenoxyphenylamino)H-pyrrolo[1,2-b]pyridazine-3-carbonitrile::CHEMBL201203

SMILES: Cc1ccn2ncc(C#N)c(Nc3ccc(Oc4ccccc4)cc3)c12

InChI Key: InChIKey=ZRKQTGNEIVHLLJ-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50176581   
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 mitogen-activated protein kinase kinase 1


(Homo sapiens (Human))
BDBM50176581
PNG
(5-methyl-4-(4-phenoxyphenylamino)H-pyrrolo[1,2-b]p...)
Show SMILES Cc1ccn2ncc(C#N)c(Nc3ccc(Oc4ccccc4)cc3)c12
Show InChI InChI=1S/C21H16N4O/c1-15-11-12-25-21(15)20(16(13-22)14-23-25)24-17-7-9-19(10-8-17)26-18-5-3-2-4-6-18/h2-12,14,24H,1H3
PDB
MMDB

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Similars

Article
PubMed
n/an/a 241n/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against MEK


Bioorg Med Chem Lett 16: 628-32 (2005)


Article DOI: 10.1016/j.bmcl.2005.10.052
BindingDB Entry DOI: 10.7270/Q2J67GHT
More data for this
Ligand-Target Pair