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

BDBM50004044 3-Hydroxy-4-methoxy-5-nitro-benzaldehyde::CHEMBL89320

SMILES: COc1c(O)cc(C=O)cc1[N+]([O-])=O

InChI Key: InChIKey=PYLFOUFNUBQBGP-UHFFFAOYSA-N

Data: 2 KI 1 IC50

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50004044
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
Catechol O-methyltransferase (Pig)	BDBM50004044 (CHEMBL89320 \| 3-Hydroxy-4-methoxy-5-nitro-benzalde...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
Catechol O-methyltransferase (Pig)	BDBM50004044 (CHEMBL89320 \| 3-Hydroxy-4-methoxy-5-nitro-benzalde...) Show SMILES Show InChI	GoogleScholar	UniChem		1.35E+4	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
Catechol O-methyltransferase (Pig)	BDBM50004044 (CHEMBL89320 \| 3-Hydroxy-4-methoxy-5-nitro-benzalde...) Show SMILES Show InChI	GoogleScholar	UniChem		1.72E+4	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