null

SMILES: O=C(CCc1nc2ccccc2c(=O)[nH]1)N[C@H]1CC[C@@H](CC1)n1c2ccccc2oc1=O

InChI Key:

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 259569   

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))	BDBM259569 (US9505749, 80) Show SMILES O=C(CCc1nc2ccccc2c(=O)[nH]1)N[C@H]1CC[C@@H](CC1)n1c2ccccc2oc1=O |r,wU:19.24,wD:16.17,(2.71,5.99,;2.71,4.45,;1.38,3.68,;.04,4.45,;-1.29,3.68,;-2.62,4.45,;-3.96,3.68,;-5.29,4.45,;-6.62,3.68,;-6.62,2.14,;-5.29,1.37,;-3.96,2.14,;-2.62,1.37,;-2.62,-.17,;-1.29,2.14,;4.04,3.68,;4.04,2.14,;2.71,1.37,;2.71,-.17,;4.04,-.94,;5.38,-.17,;5.38,1.37,;4.04,-2.48,;2.8,-3.38,;1.29,-3.06,;.26,-4.21,;.74,-5.67,;2.24,-5.99,;3.27,-4.85,;4.81,-4.85,;5.29,-3.38,;6.62,-2.61,)| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.15	n/a	n/a	n/a	n/a	n/a	n/a
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 US9505749 (2016) BindingDB Entry DOI: 10.7270/Q2FN154F
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 2 (Homo sapiens (Human))	BDBM259569 (US9505749, 80) Show SMILES O=C(CCc1nc2ccccc2c(=O)[nH]1)N[C@H]1CC[C@@H](CC1)n1c2ccccc2oc1=O |r,wU:19.24,wD:16.17,(2.71,5.99,;2.71,4.45,;1.38,3.68,;.04,4.45,;-1.29,3.68,;-2.62,4.45,;-3.96,3.68,;-5.29,4.45,;-6.62,3.68,;-6.62,2.14,;-5.29,1.37,;-3.96,2.14,;-2.62,1.37,;-2.62,-.17,;-1.29,2.14,;4.04,3.68,;4.04,2.14,;2.71,1.37,;2.71,-.17,;4.04,-.94,;5.38,-.17,;5.38,1.37,;4.04,-2.48,;2.8,-3.38,;1.29,-3.06,;.26,-4.21,;.74,-5.67,;2.24,-5.99,;3.27,-4.85,;4.81,-4.85,;5.29,-3.38,;6.62,-2.61,)| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.08E+3	n/a	n/a	n/a	n/a	n/a	n/a
AMGEN INC. US Patent					Assay Description PARP1 biochemical assay was purchased as a kit from Trevigen (cat.#4676-096-K) and used per manufacturers recommendations.PARP2 biochemical assay was...				US Patent US9505749 (2016) BindingDB Entry DOI: 10.7270/Q2FN154F
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM259569 (US9505749, 80) Show SMILES O=C(CCc1nc2ccccc2c(=O)[nH]1)N[C@H]1CC[C@@H](CC1)n1c2ccccc2oc1=O |r,wU:19.24,wD:16.17,(2.71,5.99,;2.71,4.45,;1.38,3.68,;.04,4.45,;-1.29,3.68,;-2.62,4.45,;-3.96,3.68,;-5.29,4.45,;-6.62,3.68,;-6.62,2.14,;-5.29,1.37,;-3.96,2.14,;-2.62,1.37,;-2.62,-.17,;-1.29,2.14,;4.04,3.68,;4.04,2.14,;2.71,1.37,;2.71,-.17,;4.04,-.94,;5.38,-.17,;5.38,1.37,;4.04,-2.48,;2.8,-3.38,;1.29,-3.06,;.26,-4.21,;.74,-5.67,;2.24,-5.99,;3.27,-4.85,;4.81,-4.85,;5.29,-3.38,;6.62,-2.61,)| Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.26E+3	n/a	n/a	n/a	n/a	n/a	n/a
AMGEN INC. US Patent					Assay Description PARP1 biochemical assay was purchased as a kit from Trevigen (cat.#4676-096-K) and used per manufacturers recommendations.PARP2 biochemical assay was...				US Patent US9505749 (2016) BindingDB Entry DOI: 10.7270/Q2FN154F
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-2 [946-1162] (Homo sapiens (Human))	BDBM259569 (US9505749, 80) Show SMILES O=C(CCc1nc2ccccc2c(=O)[nH]1)N[C@H]1CC[C@@H](CC1)n1c2ccccc2oc1=O |r,wU:19.24,wD:16.17,(2.71,5.99,;2.71,4.45,;1.38,3.68,;.04,4.45,;-1.29,3.68,;-2.62,4.45,;-3.96,3.68,;-5.29,4.45,;-6.62,3.68,;-6.62,2.14,;-5.29,1.37,;-3.96,2.14,;-2.62,1.37,;-2.62,-.17,;-1.29,2.14,;4.04,3.68,;4.04,2.14,;2.71,1.37,;2.71,-.17,;4.04,-.94,;5.38,-.17,;5.38,1.37,;4.04,-2.48,;2.8,-3.38,;1.29,-3.06,;.26,-4.21,;.74,-5.67,;2.24,-5.99,;3.27,-4.85,;4.81,-4.85,;5.29,-3.38,;6.62,-2.61,)| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.626	n/a	n/a	n/a	n/a	n/a	n/a
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 US9505749 (2016) BindingDB Entry DOI: 10.7270/Q2FN154F
					More data for this Ligand-Target Pair