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SMILES: COc1ccccc1Oc1ccc(Nc2c(cnn3cc(NC(=O)NCCN4CCOCC4)c(C)c23)C#N)cc1

InChI Key: InChIKey=ZVVMZLPTOJNISN-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50176559   
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))		BDBM50176559
PNG
(1-(3-cyano-4-(4-(2-methoxyphenoxy)phenylamino)-5-m...)
Show SMILES COc1ccccc1Oc1ccc(Nc2c(cnn3cc(NC(=O)NCCN4CCOCC4)c(C)c23)C#N)cc1
Show InChI InChI=1S/C29H31N7O4/c1-20-24(34-29(37)31-11-12-35-13-15-39-16-14-35)19-36-28(20)27(21(17-30)18-32-36)33-22-7-9-23(10-8-22)40-26-6-4-3-5-25(26)38-2/h3-10,18-19,33H,11-16H2,1-2H3,(H2,31,34,37)
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MMDB

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n/an/a 24n/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