BDBM523005 1-(4-(4-amino-7- cyclopropyl-7H- pyrrolo[2,3- d]pyrimidin-5-yl)-2- fluorophenyl)-3-(3- (sec-butyl)isoxazol-5- yl)urea::US11161852, Compound 30::US11713321, Example 30

SMILES CCC(C)c1cc(NC(=O)Nc2ccc(cc2F)-c2cn(C3CC3)c3ncnc(N)c23)on1

InChI Key InChIKey=IIZDMQQZFRPWRE-UHFFFAOYSA-N

Data  2 IC50

  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 2 hits for monomerid = 523005   

TargetSerine/threonine-protein kinase Nek7(Homo sapiens (Human))
Halia Therapeutics

US Patent
LigandPNGBDBM523005(1-(4-(4-amino-7- cyclopropyl-7H- pyrrolo[2,3- d]py...)
Affinity DataIC50:  225nMAssay Description:Casein substrate (from bovine milk, hydrolyzed and partially dephosphorylated mixture of α, β and κ caseins, obtained from Sigma Aldri...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent
TargetSerine/threonine-protein kinase Nek7(Homo sapiens (Human))
Halia Therapeutics

US Patent
LigandPNGBDBM523005(1-(4-(4-amino-7- cyclopropyl-7H- pyrrolo[2,3- d]py...)
Affinity DataIC50:  225nMAssay Description:Casein substrate (from bovine milk, hydrolyzed and partially dephosphorylated mixture of α, β and a caseins, obtained from Sigma Aldrich, c...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent