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BDBM372156 N-(3-((4- methylpiperazin-1- yl)methyl)phenyl)- 6-(o-tolyl)-5H- pyrrolo[3,2-d] pyrimidin-2-amine::US10239881, Example A9::US10875863, Example A9

SMILES: CN1CCN(Cc2cccc(Nc3ncc4[nH]c(cc4n3)-c3ccccc3C)c2)CC1

InChI Key: InChIKey=SPVDVGUFWOPGCZ-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 372156   
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
Serine/threonine-protein kinase RIPK2


(Homo sapiens (Human))
BDBM372156
PNG
(N-(3-((4- methylpiperazin-1- yl)methyl)phenyl)- 6-...)
Show SMILES CN1CCN(Cc2cccc(Nc3ncc4[nH]c(cc4n3)-c3ccccc3C)c2)CC1
Show InChI InChI=1S/C25H28N6/c1-18-6-3-4-9-21(18)22-15-23-24(28-22)16-26-25(29-23)27-20-8-5-7-19(14-20)17-31-12-10-30(2)11-13-31/h3-9,14-16,28H,10-13,17H2,1-2H3,(H,26,27,29)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



UNIVERSITY HEALTH NETWORK

US Patent


Assay Description
Active RIPK2 was purchased from Life Technologies as His-tagged of catalytic domain (amin acids 1-299) of human RIPK2 kinase expressed in insect cell...


US Patent US10875863 (2020)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase RIPK2


(Homo sapiens (Human))
BDBM372156
PNG
(N-(3-((4- methylpiperazin-1- yl)methyl)phenyl)- 6-...)
Show SMILES CN1CCN(Cc2cccc(Nc3ncc4[nH]c(cc4n3)-c3ccccc3C)c2)CC1
Show InChI InChI=1S/C25H28N6/c1-18-6-3-4-9-21(18)22-15-23-24(28-22)16-26-25(29-23)27-20-8-5-7-19(14-20)17-31-12-10-30(2)11-13-31/h3-9,14-16,28H,10-13,17H2,1-2H3,(H,26,27,29)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



National Taiwan University



Assay Description
RIPK2 activity was measured using an indirect ELISA detection system. His—RIPK2 (0.6 nM) was incubated in the presence of 6 μM ATP (Sigma cat # ...


J Med Chem 51: 2795-806 (2008)


BindingDB Entry DOI: 10.7270/Q289186K
More data for this
Ligand-Target Pair