BDBM36453 6-[3-[(3-Carboxy-benzylidene)aminooxypropylamino]-methyl]uracil, 6::CID25210526

SMILES: OC(=O)c1cccc(\C=N\OCCCNCc2cc(=O)[nH]c(=O)[nH]2)c1

InChI Key: InChIKey=DNNMFLCWPRQYIC-GIJQJNRQSA-N

Data: 1 IC50

PDB links: 1 PDB ID matches this monomer.

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 36453   

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
Uracil-DNA glycosylase (UNG) (Homo sapiens (Human))	BDBM36453 (6-[3-[(3-Carboxy-benzylidene)aminooxypropylamino]-...) Show SMILES OC(=O)c1cccc(\C=N\OCCCNCc2cc(=O)[nH]c(=O)[nH]2)c1 Show InChI InChI=1S/C16H18N4O5/c21-14-8-13(19-16(24)20-14)10-17-5-2-6-25-18-9-11-3-1-4-12(7-11)15(22)23/h1,3-4,7-9,17H,2,5-6,10H2,(H,22,23)(H2,19,20,21,24)/b18-9+	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	MMDB PC cid PC sid PDB UniChem	MMDB PDB Article PubMed	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	8.0	n/a
Johns Hopkins University					Assay Description Inhibition of human uracil DNA glycosylase using high-throughput fluorescent molecular beacon DNA substrate.				Nat Chem Biol 5: 407-13 (2009) Article DOI: 10.1038/nchembio.163 BindingDB Entry DOI: 10.7270/Q2W37TP8
					More data for this Ligand-Target Pair				3D Structure (crystal)