null

SMILES: CC(=O)Nc1ccc2c3C(=O)c4ccccc4-c3n(CCCO)c(=O)c2c1

InChI Key: InChIKey=JBTNBSPQXSODJB-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50425061   

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
Tyrosyl-DNA phosphodiesterase 1 (Homo sapiens (Human))	BDBM50425061 (CHEMBL2172218) Show SMILES CC(=O)Nc1ccc2c3C(=O)c4ccccc4-c3n(CCCO)c(=O)c2c1 Show InChI InChI=1S/C21H18N2O4/c1-12(25)22-13-7-8-14-17(11-13)21(27)23(9-4-10-24)19-15-5-2-3-6-16(15)20(26)18(14)19/h2-3,5-8,11,24H,4,9-10H2,1H3,(H,22,25)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.11E+5	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of recombinant Tdp1 (unknown origin) using 5'-[32P]-labeled single-stranded DNA oligonucleotide containing 3'-phosphotyrosine as substrate...				J Med Chem 56: 182-200 (2013) Article DOI: 10.1021/jm3014458 BindingDB Entry DOI: 10.7270/Q2MS3V3Z
					More data for this Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1 (Homo sapiens (Human))	BDBM50425061 (CHEMBL2172218) Show SMILES CC(=O)Nc1ccc2c3C(=O)c4ccccc4-c3n(CCCO)c(=O)c2c1 Show InChI InChI=1S/C21H18N2O4/c1-12(25)22-13-7-8-14-17(11-13)21(27)23(9-4-10-24)19-15-5-2-3-6-16(15)20(26)18(14)19/h2-3,5-8,11,24H,4,9-10H2,1H3,(H,22,25)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.80E+4	n/a	n/a	n/a	n/a	7.5	25
Purdue Research Foundation US Patent					Assay Description Tdp1 reactions were performed as recently described. Briefly, a 5'-[32P]-labeled single-stranded DNA oligonucleotide containing a 3'-phosphotyrosine ...				US Patent US8912213 (2014) BindingDB Entry DOI: 10.7270/Q2FN14XB
					More data for this Ligand-Target Pair