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SMILES: CC1(C)OC(=O)N(C1c1cccnc1)c1ccc(cc1)C(=O)Nc1cccc2cccnc12

InChI Key: InChIKey=RICUMJKOKPVLCM-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 230991   
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 [1091-1325]


(Homo sapiens (Human))		BDBM230991
PNG
(US9340549, 9)
Show SMILES CC1(C)OC(=O)N(C1c1cccnc1)c1ccc(cc1)C(=O)Nc1cccc2cccnc12 |w:7.8|
Show InChI InChI=1S/C26H22N4O3/c1-26(2)23(19-8-4-14-27-16-19)30(25(32)33-26)20-12-10-18(11-13-20)24(31)29-21-9-3-6-17-7-5-15-28-22(17)21/h3-16,23H,1-2H3,(H,29,31)
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
n/an/a 1.16E+3n/an/an/an/an/a25



AMGEN INC.

US Patent


Assay Description
The tankyrase 1 biochemical activity of the compounds was assayed in the following assay buffer (50 mM MOPS pH7.5, 100 mM NaCl, 2.5 mM MgCl2, 0.01% T...

US Patent US9340549 (2016)


BindingDB Entry DOI: 10.7270/Q2SN07VD
More data for this
Ligand-Target Pair