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SMILES: CC(CCN)c1cccc(OCC2CCCCC2)c1

InChI Key: InChIKey=POQKMXYKZIXGBY-UHFFFAOYSA-N

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 = 323465   
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))
BDBM323465
PNG
(3-(3-(Cyclohexylmethoxy)Phenyl)Butan-1-Amine | US1...)
Show SMILES CC(CCN)c1cccc(OCC2CCCCC2)c1
Show InChI InChI=1S/C17H27NO/c1-14(10-11-18)16-8-5-9-17(12-16)19-13-15-6-3-2-4-7-15/h5,8-9,12,14-15H,2-4,6-7,10-11,13,18H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



ACUCELA INC.

US Patent


Assay Description
Isomerase inhibition reactions were performed essentially as described (Stecher et al., J Biol. Chem. 274:8577-85 (1999).


US Patent US10639286 (2020)

More data for this
Ligand-Target Pair
Retinoid isomerohydrolase


(Homo sapiens (Human))
BDBM323465
PNG
(3-(3-(Cyclohexylmethoxy)Phenyl)Butan-1-Amine | US1...)
Show SMILES CC(CCN)c1cccc(OCC2CCCCC2)c1
Show InChI InChI=1S/C17H27NO/c1-14(10-11-18)16-8-5-9-17(12-16)19-13-15-6-3-2-4-7-15/h5,8-9,12,14-15H,2-4,6-7,10-11,13,18H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



ACUCELA INC.

US Patent


Assay Description
Isomerase inhibition reactions were performed essentially as described (Stecher et al., J. Biol. Chem. 274:8577-85 (1999); see also Golczak et al., P...


US Patent US10188615 (2019)


BindingDB Entry DOI: 10.7270/Q2NP26HC
More data for this
Ligand-Target Pair