BDBM572280 (3S)-N-methyl-1-[3-(2- pyridyl)-1H-pyrrolo[2,3- b]pyridin-4-yl]piperidin-3- amine::US11447505, Example E49

SMILES CN[C@H]1CCCN(C1)c1ccnc2[nH]cc(-c3ccccn3)c12

InChI Key InChIKey=CXJRRJWEPDXNLO-UHFFFAOYSA-N

Data  3 KI

  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 3 hits for monomerid = 572280   

TargetSerine/threonine-protein kinase MRCK beta(Human)
Cancer Research Technology

US Patent
LigandPNGBDBM572280((3S)-N-methyl-1-[3-(2- pyridyl)-1H-pyrrolo[2,3- b]...)
Affinity DataKi:  0.506nMAssay Description:MRCKα, MRCKβ, ROCK1 and ROCK2 assays were performed using an IMAP fluorescence polarization assay format (Molecular Devices Inc.). 8-12 nM ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/20/2022
Entry Details
US Patent

TargetRho-associated protein kinase 2(Human)
Cancer Research Technology

US Patent
LigandPNGBDBM572280((3S)-N-methyl-1-[3-(2- pyridyl)-1H-pyrrolo[2,3- b]...)
Affinity DataKi:  272nMAssay Description:MRCKα, MRCKβ, ROCK1 and ROCK2 assays were performed using an IMAP fluorescence polarization assay format (Molecular Devices Inc.). 8-12 nM ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/20/2022
Entry Details
US Patent

TargetRho-associated protein kinase 1(Human)
Cancer Research Technology

US Patent
LigandPNGBDBM572280((3S)-N-methyl-1-[3-(2- pyridyl)-1H-pyrrolo[2,3- b]...)
Affinity DataKi:  5.08E+4nMAssay Description:MRCKα, MRCKβ, ROCK1 and ROCK2 assays were performed using an IMAP fluorescence polarization assay format (Molecular Devices Inc.). 8-12 nM ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/20/2022
Entry Details
US Patent