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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Oxidized low-density lipoprotein receptor 1' and Ligand = 'BDBM454248'   
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
Oxidized low-density lipoprotein receptor 1


(Bovine)
BDBM454248
PNG
((Z)-1-(4-amino-2-fluorobut-2-en-1-yl)-3- (5-(N,N-d...)
Show SMILES CN(C)C(=O)c1ccc2n(C\C(F)=C\CN)c(C)c(-c3cncc(c3)S(=O)(=O)N(C)C)c2c1
Show InChI InChI=1S/C23H28FN5O3S/c1-15-22(17-10-19(13-26-12-17)33(31,32)28(4)5)20-11-16(23(30)27(2)3)6-7-21(20)29(15)14-18(24)8-9-25/h6-8,10-13H,9,14,25H2,1-5H3/b18-8-
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>300n/an/an/an/an/an/a


TBA

Assay Description
LOX: The assay was developed using either 384 or 96 well format. Briefly, in a standard 384 well plate assay 25 μL of a dilution of any of the i...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2QC06PC
More data for this
Ligand-Target Pair
Oxidized low-density lipoprotein receptor 1


(Bovine)
BDBM454248
PNG
((Z)-1-(4-amino-2-fluorobut-2-en-1-yl)-3- (5-(N,N-d...)
Show SMILES CN(C)C(=O)c1ccc2n(C\C(F)=C\CN)c(C)c(-c3cncc(c3)S(=O)(=O)N(C)C)c2c1
Show InChI InChI=1S/C23H28FN5O3S/c1-15-22(17-10-19(13-26-12-17)33(31,32)28(4)5)20-11-16(23(30)27(2)3)6-7-21(20)29(15)14-18(24)8-9-25/h6-8,10-13H,9,14,25H2,1-5H3/b18-8-
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>300n/an/an/an/an/an/a



Pharmaxis Ltd.

US Patent


Assay Description
LOX and LOXL2: Lysyl oxidase (LOX) is an extracellular copper dependent enzyme which oxidizes peptidyl lysine and hydroxylysine residues in collagen ...


US Patent US10717733 (2020)


BindingDB Entry DOI: 10.7270/Q29K4F8R
More data for this
Ligand-Target Pair