BDBM10561 (3S)-3-[(5-bromopyridin-3-yl)formamido]-4-oxobutanoic acid::Nicotinic Acid Aldehyde 7::aspartyl aldehyde 8

SMILES: OC(=O)C[C@H](NC(=O)c1cncc(Br)c1)C=O

InChI Key: InChIKey=FBMPVEGAIMRCBG-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 10561   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Caspase-3 (Human)	BDBM10561 ((3S)-3-[(5-bromopyridin-3-yl)formamido]-4-oxobutan...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.00E+3	n/a	n/a	n/a	n/a	7.0	37
TBA									Citation and Details
					More data for this Ligand-Target Pair
Caspase-3 (Human)	BDBM10561 ((3S)-3-[(5-bromopyridin-3-yl)formamido]-4-oxobutan...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.12E+3	n/a	n/a	n/a	n/a	7.0	37
TBA									Citation and Details
					More data for this Ligand-Target Pair