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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Retinaldehyde-binding protein 1' and Ligand = 'BDBM323419'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Retinaldehyde-binding protein 1


(Homo sapiens (Human))
BDBM323419
PNG
((R)-3-Amino-1-(3-(Cyclohexylmethoxy)Phenyl)Propan-...)
Show SMILES NCC[C@@H](O)c1cccc(OCC2CCCCC2)c1 |r|
Show InChI InChI=1S/C16H25NO2/c17-10-9-16(18)14-7-4-8-15(11-14)19-12-13-5-2-1-3-6-13/h4,7-8,11,13,16,18H,1-3,5-6,9-10,12,17H2/t16-/m1/s1
PDB

UniProtKB/SwissProt

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MCE
PC cid
PC sid
PDB
UniChem
US Patent
n/an/a<100n/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)


BindingDB Entry DOI: 10.7270/Q21Z47G8
More data for this
Ligand-Target Pair
Retinaldehyde-binding protein 1


(Bovine)
BDBM323419
PNG
((R)-3-Amino-1-(3-(Cyclohexylmethoxy)Phenyl)Propan-...)
Show SMILES NCC[C@@H](O)c1cccc(OCC2CCCCC2)c1 |r|
Show InChI InChI=1S/C16H25NO2/c17-10-9-16(18)14-7-4-8-15(11-14)19-12-13-5-2-1-3-6-13/h4,7-8,11,13,16,18H,1-3,5-6,9-10,12,17H2/t16-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

MCE
PC cid
PC sid
PDB
UniChem
US Patent
n/an/a<100n/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)


BindingDB Entry DOI: 10.7270/Q21Z47G8
More data for this
Ligand-Target Pair