null

SMILES COc1cc(cc(OC)c1OC)-c1cnc(N)c(n1)N1CC[C@H]([C@@H](C)[C@H]1C)C(O)=O

InChI Key InChIKey=YPKLAWUGDWZBMV-OUCADQQQSA-N

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50330575   

TargetSerine/threonine-protein kinase Chk1(Homo sapiens (Human))
Institute of Cancer Research

Curated by ChEMBL
LigandPNGBDBM50330575((-)-(2R,3R,4R)-1-(3-Amino-6-(3,4,5-trimethoxypheny...)copy SMILEScopy InChI
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of CHK1More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q23J3D79PubMed
TargetSerine/threonine-protein kinase Nek2(Homo sapiens (Human))
Institute of Cancer Research

Curated by ChEMBL
LigandPNGBDBM50330575((-)-(2R,3R,4R)-1-(3-Amino-6-(3,4,5-trimethoxypheny...)copy SMILEScopy InChI
Affinity DataIC50: 230nMAssay Description:Inhibition of NEK2 by microfluidic assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q23J3D79PubMed
TargetSerine/threonine-protein kinase PLK1(Homo sapiens (Human))
Institute of Cancer Research

Curated by ChEMBL
LigandPNGBDBM50330575((-)-(2R,3R,4R)-1-(3-Amino-6-(3,4,5-trimethoxypheny...)copy SMILEScopy InChI
Affinity DataIC50: 1.94E+4nMT: 2°CAssay Description:Inhibition of PLK1 after 75 mins at room temperature by caliper methodMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q23J3D79PubMed
TargetSerine/threonine-protein kinase Nek2(Homo sapiens (Human))
Institute of Cancer Research

Curated by ChEMBL
LigandPNGBDBM50330575((-)-(2R,3R,4R)-1-(3-Amino-6-(3,4,5-trimethoxypheny...)copy SMILEScopy InChI
Affinity DataIC50: 300nMAssay Description:Inhibition of NEK2 assessed as inhibition of substrate phosphorylationMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q23J3D79PubMed
TargetSerine/threonine-protein kinase Nek1(Homo sapiens (Human))
Institute of Cancer Research

Curated by ChEMBL
LigandPNGBDBM50330575((-)-(2R,3R,4R)-1-(3-Amino-6-(3,4,5-trimethoxypheny...)copy SMILEScopy InChI
Affinity DataIC50: 170nMT: 2°CAssay Description:Inhibition of NEK1 after 1 hr at room temperature by caliper methodMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q23J3D79PubMed
TargetSerine/threonine-protein kinase Nek2(Homo sapiens (Human))
Institute of Cancer Research

Curated by ChEMBL
LigandPNGBDBM50330575((-)-(2R,3R,4R)-1-(3-Amino-6-(3,4,5-trimethoxypheny...)copy SMILEScopy InChI
Affinity DataIC50: 200nMAssay Description:Inhibition of NEK2 assessed as inhibition of substrate phosphorylationMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q23J3D79PubMed