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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'C-C chemokine receptor-like 2' and Ligand = 'BDBM163294'   
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
C-C chemokine receptor-like 2


(Homo sapiens (Human))
BDBM163294
PNG
(US9062048, 16)
Show SMILES FC(F)(F)c1ccc2ncnc(NCC(=O)NC3CN(C3)[C@@H]3CC[C@@H](CC3)C3COC(=O)N3)c2c1 |r,wU:24.28,21.21,(6.02,4.1,;7.56,4.1,;8.33,5.44,;6.79,5.44,;8.33,2.77,;9.87,2.77,;10.64,1.44,;9.87,.1,;10.64,-1.23,;9.87,-2.56,;8.33,-2.56,;7.56,-1.23,;6.02,-1.23,;5.25,-2.56,;3.71,-2.56,;2.94,-1.23,;2.94,-3.9,;1.4,-3.9,;.31,-4.99,;-.78,-3.9,;.31,-2.81,;-2.32,-3.9,;-3.09,-2.56,;-4.63,-2.56,;-5.4,-3.9,;-4.63,-5.23,;-3.09,-5.23,;-6.94,-3.9,;-7.84,-2.65,;-9.31,-3.13,;-9.31,-4.67,;-10.64,-5.44,;-7.84,-5.14,;8.33,.1,;7.56,1.44,)|
Show InChI InChI=1S/C23H27F3N6O3/c24-23(25,26)14-3-6-18-17(7-14)21(29-12-28-18)27-8-20(33)30-15-9-32(10-15)16-4-1-13(2-5-16)19-11-35-22(34)31-19/h3,6-7,12-13,15-16,19H,1-2,4-5,8-11H2,(H,30,33)(H,31,34)(H,27,28,29)/t13-,16+,19?
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 35n/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
Human monocytic cell line THP-1 cells were obtained from American Type Culture Collection (Manassas, Va., USA). The THP-1 cells were grown in RPMI-16...


US Patent US9062048 (2015)


BindingDB Entry DOI: 10.7270/Q2ZP44W1
More data for this
Ligand-Target Pair