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BDBM318020 8-Methyl-2-[4-[(4- methylpyrimidin-2- yl)methyl]piperazin-1-yl]- 3,5,6,7-tetrahydropyrido[2,3- d]pyrimidin-4-one::US9624218, Example 14

SMILES: CN1CCCc2c1nc([nH]c2=O)N1CCN(Cc2nccc(C)n2)CC1

InChI Key: InChIKey=IGKALBMMBUOLAY-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 318020   
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
Poly [ADP-ribose] polymerase tankyrase-1


(Homo sapiens (Human))
BDBM318020
PNG
(8-Methyl-2-[4-[(4- methylpyrimidin-2- yl)methyl]pi...)
Show SMILES CN1CCCc2c1nc([nH]c2=O)N1CCN(Cc2nccc(C)n2)CC1
Show InChI InChI=1S/C18H25N7O/c1-13-5-6-19-15(20-13)12-24-8-10-25(11-9-24)18-21-16-14(17(26)22-18)4-3-7-23(16)2/h5-6H,3-4,7-12H2,1-2H3,(H,21,22,26)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 22.8n/an/an/an/an/an/a



Eli Lilly and Company

US Patent


Assay Description
The enzymatic activity of hTNKS1 and hTNKS2 is assessed using an enzyme-linked immunosorbent assay (ELISA) which detects poly ADP ribose incorporated...


US Patent US9624218 (2017)


BindingDB Entry DOI: 10.7270/Q26112CZ
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))
BDBM318020
PNG
(8-Methyl-2-[4-[(4- methylpyrimidin-2- yl)methyl]pi...)
Show SMILES CN1CCCc2c1nc([nH]c2=O)N1CCN(Cc2nccc(C)n2)CC1
Show InChI InChI=1S/C18H25N7O/c1-13-5-6-19-15(20-13)12-24-8-10-25(11-9-24)18-21-16-14(17(26)22-18)4-3-7-23(16)2/h5-6H,3-4,7-12H2,1-2H3,(H,21,22,26)
PDB
MMDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 5.66E+3n/an/an/an/an/an/a



Eli Lilly and Company

US Patent


Assay Description
The Poly ADP-ribose polymerase 1(PARP1) assay is an ELISA which detects poly ADP ribose incorporated into plate-bound histone protein in a 384-well f...


US Patent US9624218 (2017)


BindingDB Entry DOI: 10.7270/Q26112CZ
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-2


(Homo sapiens (Human))
BDBM318020
PNG
(8-Methyl-2-[4-[(4- methylpyrimidin-2- yl)methyl]pi...)
Show SMILES CN1CCCc2c1nc([nH]c2=O)N1CCN(Cc2nccc(C)n2)CC1
Show InChI InChI=1S/C18H25N7O/c1-13-5-6-19-15(20-13)12-24-8-10-25(11-9-24)18-21-16-14(17(26)22-18)4-3-7-23(16)2/h5-6H,3-4,7-12H2,1-2H3,(H,21,22,26)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 11.7n/an/an/an/an/an/a



Eli Lilly and Company

US Patent


Assay Description
The enzymatic activity of hTNKS1 and hTNKS2 is assessed using an enzyme-linked immunosorbent assay (ELISA) which detects poly ADP ribose incorporated...


US Patent US9624218 (2017)


BindingDB Entry DOI: 10.7270/Q26112CZ
More data for this
Ligand-Target Pair