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BDBM338948 (E)-4-(3-(2-aminoethoxy)styryl)heptan-4-ol::US10201545, Compound 85

SMILES: CCCC(O)(CCC)\C=C\c1cccc(OCCN)c1

InChI Key: InChIKey=HGAFCTJJXJRDBW-DHZHZOJOSA-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 = 338948   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Retinaldehyde-binding protein 1


(Homo sapiens (Human))
BDBM338948
PNG
((E)-4-(3-(2-aminoethoxy)styryl)heptan-4-ol | US102...)
Show SMILES CCCC(O)(CCC)\C=C\c1cccc(OCCN)c1
Show InChI InChI=1S/C17H27NO2/c1-3-9-17(19,10-4-2)11-8-15-6-5-7-16(14-15)20-13-12-18/h5-8,11,14,19H,3-4,9-10,12-13,18H2,1-2H3/b11-8+
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a<1.00E+3n/an/an/an/an/an/a



ACUCELA INC.

US Patent


Assay Description
The isomerase assay was performed in 10 mM bis-tris-propane (BTP) buffer, pH 7.5, 0.5% BSA (diluted in BTP buffer), 1 mM sodium pyrophosphate, 20 ...


US Patent US10201545 (2019)

More data for this
Ligand-Target Pair