BindingDB PrimarySearch_ki

Search and Browse
- Target
- Compound
- Special tools
- Citation
- Special Data Sets
- Other Databases
  - PDB 85% 100% Seq ID
  - UniProtKB/Swiss-Prot
  - UniProtKB/TrEMBL
  - PubMed
Download
- All Compounds & Data
- Target Names &
  - Ki IC50 Kd EC50
  - ΔG° ΔH° -TΔS°
Enter Data

BDBM22748 1-(4-methyl-3-nitrophenyl)-2-phenylethane-1,2-dione::Benzil-based compound, 26

SMILES: Cc1ccc(cc1[N+]([O-])=O)C(=O)C(=O)c1ccccc1

InChI Key: InChIKey=JWRFKIOVIXSJAH-UHFFFAOYSA-N

Data: 6 KI

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 22748
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Coagulation factor XII (Human)	BDBM22748 (1-(4-methyl-3-nitrophenyl)-2-phenylethane-1,2-dion...) Show SMILES Show InChI	GoogleScholar	UniChem		7.90	-11.0	n/a	n/a	n/a	n/a	n/a	7.4	25
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
Liver carboxylesterase 1 (Rabbit)	BDBM22748 (1-(4-methyl-3-nitrophenyl)-2-phenylethane-1,2-dion...) Show SMILES Show InChI	GoogleScholar	UniChem		11.9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
Liver carboxylesterase 1 (Human)	BDBM22748 (1-(4-methyl-3-nitrophenyl)-2-phenylethane-1,2-dion...) Show SMILES Show InChI	GoogleScholar	UniChem		295	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
Liver carboxylesterase 1 (Human)	BDBM22748 (1-(4-methyl-3-nitrophenyl)-2-phenylethane-1,2-dion...) Show SMILES Show InChI	GoogleScholar	UniChem		295	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
Acetylcholinesterase (Human)	BDBM22748 (1-(4-methyl-3-nitrophenyl)-2-phenylethane-1,2-dion...) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
Cholinesterase (Human)	BDBM22748 (1-(4-methyl-3-nitrophenyl)-2-phenylethane-1,2-dion...) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair