BDBM91980 erk000048

SMILES CCNc1ncc(C)c(n1)-c1c[nH]c(c1)C(=O)N[C@@H](CO)c1ccccc1

InChI Key InChIKey=NDOCIMFSMXVIQA-KRWDZBQOSA-N

Data  2 KI

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 91980   

TargetMitogen-activated protein kinase 1(Homo sapiens (Human))
CSAR

LigandPNGBDBM91980(erk000048)
Show SMILES CCNc1ncc(C)c(n1)-c1c[nH]c(c1)C(=O)N[C@@H](CO)c1ccccc1
Show InChI InChI=1S/C20H23N5O2/c1-3-21-20-23-10-13(2)18(25-20)15-9-16(22-11-15)19(27)24-17(12-26)14-7-5-4-6-8-14/h4-11,17,22,26H,3,12H2,1-2H3,(H,24,27)(H,21,23,25)/t17-/m0/s1
Affinity DataKi:  1.29E+4nMAssay Description:Assay 1 ...More data for this Ligand-Target Pair
In DepthDetails PubMed
TargetMitogen-activated protein kinase 1(Homo sapiens (Human))
CSAR

LigandPNGBDBM91980(erk000048)
Show SMILES CCNc1ncc(C)c(n1)-c1c[nH]c(c1)C(=O)N[C@@H](CO)c1ccccc1
Show InChI InChI=1S/C20H23N5O2/c1-3-21-20-23-10-13(2)18(25-20)15-9-16(22-11-15)19(27)24-17(12-26)14-7-5-4-6-8-14/h4-11,17,22,26H,3,12H2,1-2H3,(H,24,27)(H,21,23,25)/t17-/m0/s1
Affinity DataKi:  1.29E+4nMAssay Description:Photometric_Method2More data for this Ligand-Target Pair
In DepthDetails PubMed