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BDBM372151 N-(3-(4- methylpiperazin-1- yl)phenyl)- 6-(o-tolyl)- 5H-pyrrolo[3,2- d]pyrimidin-2- amine::US10239881, Example A4::US10875863, Example A4

SMILES: CN1CCN(CC1)c1cccc(Nc2ncc3[nH]c(cc3n2)-c2ccccc2C)c1

InChI Key: InChIKey=ALYAWVYQFNRNAO-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 = 372151   
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))
BDBM372151
PNG
(N-(3-(4- methylpiperazin-1- yl)phenyl)- 6-(o-tolyl...)
Show SMILES CN1CCN(CC1)c1cccc(Nc2ncc3[nH]c(cc3n2)-c2ccccc2C)c1
Show InChI InChI=1S/C24H26N6/c1-17-6-3-4-9-20(17)21-15-22-23(27-21)16-25-24(28-22)26-18-7-5-8-19(14-18)30-12-10-29(2)11-13-30/h3-9,14-16,27H,10-13H2,1-2H3,(H,25,26,28)
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))
BDBM372151
PNG
(N-(3-(4- methylpiperazin-1- yl)phenyl)- 6-(o-tolyl...)
Show SMILES CN1CCN(CC1)c1cccc(Nc2ncc3[nH]c(cc3n2)-c2ccccc2C)c1
Show InChI InChI=1S/C24H26N6/c1-17-6-3-4-9-20(17)21-15-22-23(27-21)16-25-24(28-22)26-18-7-5-8-19(14-18)30-12-10-29(2)11-13-30/h3-9,14-16,27H,10-13H2,1-2H3,(H,25,26,28)
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