null

SMILES: CC1(C)OC(=O)N([C@H]1c1ccccc1)[C@H]1CC[C@H](CC1)c1cnc2ccn(-c3ncccn3)c2c1

InChI Key: InChIKey=FCVUTKPTZRWMKB-SWHJIRTISA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 231152   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Poly [ADP-ribose] polymerase tankyrase-1 [1091-1325] (Homo sapiens (Human))	BDBM231152 (US9340549, 174) Show SMILES CC1(C)OC(=O)N([C@H]1c1ccccc1)[C@H]1CC[C@H](CC1)c1cnc2ccn(-c3ncccn3)c2c1 |r,wU:7.8,wD:14.15,17.22,(-6.93,-3.44,;-6.16,-2.11,;-5.39,-3.44,;-7.06,-.86,;-6.16,.38,;-6.93,1.72,;-4.69,-.09,;-4.69,-1.63,;-3.6,-2.72,;-4,-4.21,;-2.91,-5.3,;-1.42,-4.9,;-1.03,-3.41,;-2.11,-2.32,;-3.36,.68,;-2.02,-.09,;-.69,.68,;-.69,2.22,;-2.02,2.99,;-3.36,2.22,;.64,2.99,;.64,4.53,;1.98,5.3,;3.31,4.53,;4.78,5,;5.68,3.76,;4.78,2.51,;5.17,1.02,;4.09,-.06,;4.48,-1.55,;5.97,-1.95,;7.06,-.86,;6.66,.63,;3.31,2.99,;1.98,2.22,)| Show InChI InChI=1S/C28H29N5O2/c1-28(2)25(20-7-4-3-5-8-20)33(27(34)35-28)22-11-9-19(10-12-22)21-17-24-23(31-18-21)13-16-32(24)26-29-14-6-15-30-26/h3-8,13-19,22,25H,9-12H2,1-2H3/t19-,22+,25-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.01	n/a	n/a	n/a	n/a	n/a	25
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