BDBM185160 2-Naphthylmethyl 4-[2-[(2-bromoacetyl)amino]acetyl]piperazine-1-carboxylate (6c)

SMILES: BrCC(=O)NCC(=O)N1CCN(CC1)C(=O)OCc1ccc2ccccc2c1

InChI Key: InChIKey=AEZFRLPYRHLADP-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 = 185160   

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
Protein-glutamine gamma-glutamyltransferase 2 (TG2) (Homo sapiens (Human))	BDBM185160 (2-Naphthylmethyl 4-[2-[(2-bromoacetyl)amino]acetyl...) Show SMILES BrCC(=O)NCC(=O)N1CCN(CC1)C(=O)OCc1ccc2ccccc2c1 Show InChI InChI=1S/C20H22BrN3O4/c21-12-18(25)22-13-19(26)23-7-9-24(10-8-23)20(27)28-14-15-5-6-16-3-1-2-4-17(16)11-15/h1-6,11H,7-10,12-14H2,(H,22,25)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
Aston University					Assay Description For measurement of TG2 activity, the incorporation of biotinylated cadaverineinto immobilized N,N-dimethylcasein was used as described previously (Wa...				Chem Biol 22: 1347-61 (2015) Article DOI: 10.1016/j.chembiol.2015.08.013 BindingDB Entry DOI: 10.7270/Q2222SJC
					More data for this Ligand-Target Pair