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BDBM207559 US9260440, 4::US9617273, Example 4

SMILES: CC1(C)CCc2[nH]c3cccc4c3c2c1n[nH]c4=O

InChI Key: InChIKey=WCAMYOIGSKFYKH-UHFFFAOYSA-N

Data: 4 IC50

Find this compound or compounds like it in BindingDB or PDB:
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 207559   
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 1


(Homo sapiens (Human))
BDBM207559
PNG
(US9260440, 4 | US9617273, Example 4)
Show SMILES CC1(C)CCc2[nH]c3cccc4c3c2c1n[nH]c4=O
Show InChI InChI=1S/C15H15N3O/c1-15(2)7-6-10-12-11-8(4-3-5-9(11)16-10)14(19)18-17-13(12)15/h3-5,16H,6-7H2,1-2H3,(H,18,19)
PDB
MMDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 18.6n/an/an/an/a8.0n/a



BeiGene, Ltd

US Patent


Assay Description
PARP-1 enzymatic assay was conducted using a method modified from HT F Homogeneous PARP Inhibition Assay Kit (Trevigen). 8.8 nM PARP-1 was pre-incuba...


US Patent US9260440 (2016)


BindingDB Entry DOI: 10.7270/Q2QV3KBD
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-2


(Homo sapiens (Human))
BDBM207559
PNG
(US9260440, 4 | US9617273, Example 4)
Show SMILES CC1(C)CCc2[nH]c3cccc4c3c2c1n[nH]c4=O
Show InChI InChI=1S/C15H15N3O/c1-15(2)7-6-10-12-11-8(4-3-5-9(11)16-10)14(19)18-17-13(12)15/h3-5,16H,6-7H2,1-2H3,(H,18,19)
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
n/an/a 1.05E+6n/an/an/an/an/an/a



BeiGene, Ltd

US Patent


Assay Description
Tankyrase-2 enzymatic assay was conducted using commercial Tankyrase-2 Chemiluminescent Assay Kit (BPS Biosciences) and the protocol with the kit. GS...


US Patent US9617273 (2017)


Article DOI: 10.1021/jm0512600
BindingDB Entry DOI: 10.7270/Q2CN75ZV
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))
BDBM207559
PNG
(US9260440, 4 | US9617273, Example 4)
Show SMILES CC1(C)CCc2[nH]c3cccc4c3c2c1n[nH]c4=O
Show InChI InChI=1S/C15H15N3O/c1-15(2)7-6-10-12-11-8(4-3-5-9(11)16-10)14(19)18-17-13(12)15/h3-5,16H,6-7H2,1-2H3,(H,18,19)
PDB
MMDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
n/an/a 1.86E+4n/an/an/an/an/an/a



BeiGene, Ltd

US Patent


Assay Description
PARP-1 enzymatic assay was conducted using a method modified from HT F Homogeneous PARP Inhibition Assay Kit (Trevigen). 8.8 nM PARP-1 was pre-incuba...


US Patent US9617273 (2017)


Article DOI: 10.1021/jm0512600
BindingDB Entry DOI: 10.7270/Q2CN75ZV
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-2


(Homo sapiens (Human))
BDBM207559
PNG
(US9260440, 4 | US9617273, Example 4)
Show SMILES CC1(C)CCc2[nH]c3cccc4c3c2c1n[nH]c4=O
Show InChI InChI=1S/C15H15N3O/c1-15(2)7-6-10-12-11-8(4-3-5-9(11)16-10)14(19)18-17-13(12)15/h3-5,16H,6-7H2,1-2H3,(H,18,19)
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 1.05E+3n/an/an/an/an/an/a



BeiGene, Ltd

US Patent


Assay Description
Tankyrase-2 enzymatic assay was conducted using commercial Tankyrase-2 Chemiluminescent Assay Kit (BPS Biosciences) and the protocol with the kit. GS...


US Patent US9260440 (2016)


BindingDB Entry DOI: 10.7270/Q2QV3KBD
More data for this
Ligand-Target Pair