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SMILES: Cc1nnc(s1)-n1c2cc(ccc2n(Cc2ccc(F)cc2)c1=O)S(=O)(=O)NC1(C)CC1

InChI Key: InChIKey=LQKYFGQCPMYDCJ-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 421482   

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) glycohydrolase (Homo sapiens (Human))	BDBM421482 (US10508086, Example 73 | US10995073, Example 73) Show SMILES Cc1nnc(s1)-n1c2cc(ccc2n(Cc2ccc(F)cc2)c1=O)S(=O)(=O)NC1(C)CC1 Show InChI InChI=1S/C21H20FN5O3S2/c1-13-23-24-19(31-13)27-18-11-16(32(29,30)25-21(2)9-10-21)7-8-17(18)26(20(27)28)12-14-3-5-15(22)6-4-14/h3-8,11,25H,9-10,12H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	636	n/a	n/a	n/a	n/a
Cancer Research Technology Limited US Patent					Assay Description PARG In vitro assays were conducted in a total volume of 15 ul in a standard 384 well format. 5 ul of Human Full Length PARG (Produced internally by ...				US Patent US10508086 (2019) BindingDB Entry DOI: 10.7270/Q26112QF
					More data for this Ligand-Target Pair
ADP-ribosylhydrolase ARH3 (Homo sapiens (Human))	BDBM421482 (US10508086, Example 73 | US10995073, Example 73) Show SMILES Cc1nnc(s1)-n1c2cc(ccc2n(Cc2ccc(F)cc2)c1=O)S(=O)(=O)NC1(C)CC1 Show InChI InChI=1S/C21H20FN5O3S2/c1-13-23-24-19(31-13)27-18-11-16(32(29,30)25-21(2)9-10-21)7-8-17(18)26(20(27)28)12-14-3-5-15(22)6-4-14/h3-8,11,25H,9-10,12H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Cancer Research Technology Limited US Patent					Assay Description ARH3 In vitro selectivity assays were conducted in a total volume of 15 ul in a standard 384 well format. 5 ul of Human Full Length ARH3 (Enzo Life S...				US Patent US10508086 (2019) BindingDB Entry DOI: 10.7270/Q26112QF
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM421482 (US10508086, Example 73 | US10995073, Example 73) Show SMILES Cc1nnc(s1)-n1c2cc(ccc2n(Cc2ccc(F)cc2)c1=O)S(=O)(=O)NC1(C)CC1 Show InChI InChI=1S/C21H20FN5O3S2/c1-13-23-24-19(31-13)27-18-11-16(32(29,30)25-21(2)9-10-21)7-8-17(18)26(20(27)28)12-14-3-5-15(22)6-4-14/h3-8,11,25H,9-10,12H2,1-2H3	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
Cancer Research Technology Limited US Patent					Assay Description PARP1 In vitro selectivity assays were conducted as a 10 ul reaction volume in a NUNC Maxisorp 384-well assay plate pre-coated in-house with Histones...				US Patent US10995073 (2021)
					More data for this Ligand-Target Pair
Poly(ADP-ribose) glycohydrolase (Homo sapiens (Human))	BDBM421482 (US10508086, Example 73 | US10995073, Example 73) Show SMILES Cc1nnc(s1)-n1c2cc(ccc2n(Cc2ccc(F)cc2)c1=O)S(=O)(=O)NC1(C)CC1 Show InChI InChI=1S/C21H20FN5O3S2/c1-13-23-24-19(31-13)27-18-11-16(32(29,30)25-21(2)9-10-21)7-8-17(18)26(20(27)28)12-14-3-5-15(22)6-4-14/h3-8,11,25H,9-10,12H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	636	n/a	n/a	n/a	n/a
Cancer Research Technology Limited US Patent					Assay Description PARG In vitro assays were conducted in a total volume of 15 ul in a standard 384 well format. 5 ul of Human Full Length PARG (Produced internally by ...				US Patent US10995073 (2021)
					More data for this Ligand-Target Pair
ADP-ribosylhydrolase ARH3 (Homo sapiens (Human))	BDBM421482 (US10508086, Example 73 | US10995073, Example 73) Show SMILES Cc1nnc(s1)-n1c2cc(ccc2n(Cc2ccc(F)cc2)c1=O)S(=O)(=O)NC1(C)CC1 Show InChI InChI=1S/C21H20FN5O3S2/c1-13-23-24-19(31-13)27-18-11-16(32(29,30)25-21(2)9-10-21)7-8-17(18)26(20(27)28)12-14-3-5-15(22)6-4-14/h3-8,11,25H,9-10,12H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Cancer Research Technology Limited US Patent					Assay Description ARH3 In vitro selectivity assays were conducted in a total volume of 15 ul in a standard 384 well format. 5 ul of Human Full Length ARH3 (Enzo Life S...				US Patent US10995073 (2021)
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM421482 (US10508086, Example 73 | US10995073, Example 73) Show SMILES Cc1nnc(s1)-n1c2cc(ccc2n(Cc2ccc(F)cc2)c1=O)S(=O)(=O)NC1(C)CC1 Show InChI InChI=1S/C21H20FN5O3S2/c1-13-23-24-19(31-13)27-18-11-16(32(29,30)25-21(2)9-10-21)7-8-17(18)26(20(27)28)12-14-3-5-15(22)6-4-14/h3-8,11,25H,9-10,12H2,1-2H3	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
Cancer Research Technology Limited US Patent					Assay Description PARP1 In vitro selectivity assays were conducted as a 10 ul reaction volume in a NUNC Maxisorp 384-well assay plate pre-coated in-house with Histones...				US Patent US10508086 (2019) BindingDB Entry DOI: 10.7270/Q26112QF
					More data for this Ligand-Target Pair