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

BDBM50213553 (S)-2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)propanoic acid::CHEMBL236433

SMILES: C[C@H](C(O)=O)c1ccc2OCCOc2c1

InChI Key: InChIKey=REEHPTZXDPTHNZ-UHFFFAOYSA-N

Data: 4 IC50

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50213553
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
Dehydrogenase/reductase SDR family member 9 (Rat)	BDBM50213553 ((S)-2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)propano...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 2 (Human)	BDBM50213553 ((S)-2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)propano...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.65E+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
Dehydrogenase/reductase SDR family member 9 (Rat)	BDBM50213553 ((S)-2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)propano...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1 (Human)	BDBM50213553 ((S)-2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)propano...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.30E+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