BDBM50351571 CHEMBL1825011

SMILES: Nc1nc2nc(cnc2c(=O)[nH]1)C(=O)NCc1ccccn1

InChI Key: InChIKey=IOVIZPQNGDWMTK-UHFFFAOYSA-N

Data: 1 IC50

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 = 50351571   

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
Ricin (Ricinus communis)	BDBM50351571 (CHEMBL1825011) Show SMILES Nc1nc2nc(cnc2c(=O)[nH]1)C(=O)NCc1ccccn1 Show InChI InChI=1S/C13H11N7O2/c14-13-19-10-9(12(22)20-13)16-6-8(18-10)11(21)17-5-7-3-1-2-4-15-7/h1-4,6H,5H2,(H,17,21)(H3,14,18,19,20,22)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas at Austin Curated by ChEMBL					Assay Description Inhibition of castor seed ricin A chain translation degradation activity in rabbit reticulocyte lysate after 90 mins by luciferase-based luminometer ...				Eur J Med Chem 46: 3608-15 (2011) Article DOI: 10.1016/j.ejmech.2011.05.025 BindingDB Entry DOI: 10.7270/Q2D21Z00
					More data for this Ligand-Target Pair				3D Structure (docked)