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SMILES: CN1CCCc2c1nc([nH]c2=O)N1CCN(Cc2ncccc2C#N)CC1

InChI Key: InChIKey=FXPQKIUFVMHDMQ-UHFFFAOYSA-N

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 = 318039   
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))
BDBM318039
PNG
(2-[[4-(8-Methyl-4-oxo-3,5,6,7-tetrahydropyrido[2,3...)
Show SMILES CN1CCCc2c1nc([nH]c2=O)N1CCN(Cc2ncccc2C#N)CC1
Show InChI InChI=1S/C19H23N7O/c1-24-7-3-5-15-17(24)22-19(23-18(15)27)26-10-8-25(9-11-26)13-16-14(12-20)4-2-6-21-16/h2,4,6H,3,5,7-11,13H2,1H3,(H,22,23,27)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 14.3n/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))
BDBM318039
PNG
(2-[[4-(8-Methyl-4-oxo-3,5,6,7-tetrahydropyrido[2,3...)
Show SMILES CN1CCCc2c1nc([nH]c2=O)N1CCN(Cc2ncccc2C#N)CC1
Show InChI InChI=1S/C19H23N7O/c1-24-7-3-5-15-17(24)22-19(23-18(15)27)26-10-8-25(9-11-26)13-16-14(12-20)4-2-6-21-16/h2,4,6H,3,5,7-11,13H2,1H3,(H,22,23,27)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 2.84E+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))
BDBM318039
PNG
(2-[[4-(8-Methyl-4-oxo-3,5,6,7-tetrahydropyrido[2,3...)
Show SMILES CN1CCCc2c1nc([nH]c2=O)N1CCN(Cc2ncccc2C#N)CC1
Show InChI InChI=1S/C19H23N7O/c1-24-7-3-5-15-17(24)22-19(23-18(15)27)26-10-8-25(9-11-26)13-16-14(12-20)4-2-6-21-16/h2,4,6H,3,5,7-11,13H2,1H3,(H,22,23,27)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 8.41n/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