BDBM50385516 CHEMBL2040570

SMILES: CCCCNC(=O)c1nc([nH]c(=O)c1O)-c1cnccn1

InChI Key: InChIKey=SMBVWWHYFYTSSR-UHFFFAOYSA-N

Data: 1 KI  1 EC50

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 2 hits for monomerid = 50385516   

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
PA/PB1 (Hepatitis C virus)	BDBM50385516 (CHEMBL2040570) Show SMILES CCCCNC(=O)c1nc([nH]c(=O)c1O)-c1cnccn1 Show InChI InChI=1S/C13H15N5O3/c1-2-3-4-16-12(20)9-10(19)13(21)18-11(17-9)8-7-14-5-6-15-8/h5-7,19H,2-4H2,1H3,(H,16,20)(H,17,18,21)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.86E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Tennessee Health Science Center Curated by ChEMBL					Assay Description Binding affinity to PA N-terminal domain (Competitive)				ACS Chem Biol 7: 526-34 (2012) Article DOI: 10.1021/cb200439z BindingDB Entry DOI: 10.7270/Q2JQ121G
					More data for this Ligand-Target Pair
PA/PB1 (Hepatitis C virus)	BDBM50385516 (CHEMBL2040570) Show SMILES CCCCNC(=O)c1nc([nH]c(=O)c1O)-c1cnccn1 Show InChI InChI=1S/C13H15N5O3/c1-2-3-4-16-12(20)9-10(19)13(21)18-11(17-9)8-7-14-5-6-15-8/h5-7,19H,2-4H2,1H3,(H,16,20)(H,17,18,21)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	8.81E+4	n/a	n/a	n/a	n/a
University of Tennessee Health Science Center Curated by ChEMBL					Assay Description Plaque growth inhibition				ACS Chem Biol 7: 526-34 (2012) Article DOI: 10.1021/cb200439z BindingDB Entry DOI: 10.7270/Q2JQ121G
					More data for this Ligand-Target Pair