BDBM50424239 CHEMBL2314140

SMILES: C[C@H](NC(=O)c1cnc2c(nc(N)[nH]c2=O)n1)C(=O)N[C@@H](Cc1ccccc1)C(O)=O

InChI Key: InChIKey=HMLWEHMRLLXUDM-ONGXEEELSA-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 = 50424239   

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)	BDBM50424239 (CHEMBL2314140) Show SMILES C[C@H](NC(=O)c1cnc2c(nc(N)[nH]c2=O)n1)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r| Show InChI InChI=1S/C19H19N7O5/c1-9(15(27)24-11(18(30)31)7-10-5-3-2-4-6-10)22-16(28)12-8-21-13-14(23-12)25-19(20)26-17(13)29/h2-6,8-9,11H,7H2,1H3,(H,22,28)(H,24,27)(H,30,31)(H3,20,23,25,26,29)/t9-,11-/m0/s1	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	2.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Toho University Curated by ChEMBL					Assay Description Inhibition of Ricin toxin A after 90 mins by luciferase-translational assay				J Med Chem 56: 320-9 (2013) Article DOI: 10.1021/jm3016393 BindingDB Entry DOI: 10.7270/Q2SN0B81
					More data for this Ligand-Target Pair