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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 = 'BDBM163444'   
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))
BDBM163444
PNG
(US9062048, 71)
Show SMILES Nc1cccnc1[C@H]1CCC(CC1)N1CC(C1)NC(=O)CNc1ncnc2ccc(cc12)C(F)(F)F |r,wU:7.7,(-7.25,-.67,;-8.02,.67,;-9.56,.67,;-10.33,2,;-9.56,3.33,;-8.02,3.33,;-7.25,2,;-5.71,2,;-4.94,3.33,;-3.4,3.33,;-2.63,2,;-3.4,.67,;-4.94,.67,;-1.09,2,;,3.09,;1.09,2,;,.91,;2.63,2,;3.4,.67,;2.63,-.67,;4.94,.67,;5.71,2,;7.25,2,;8.02,3.33,;9.56,3.33,;10.33,2,;9.56,.67,;10.33,-.67,;9.56,-2,;8.02,-2,;7.25,-.67,;8.02,.67,;7.25,-3.33,;6.48,-4.67,;5.71,-3.33,;8.02,-4.67,)|
Show InChI InChI=1S/C25H28F3N7O/c26-25(27,28)16-5-8-21-19(10-16)24(33-14-32-21)31-11-22(36)34-17-12-35(13-17)18-6-3-15(4-7-18)23-20(29)2-1-9-30-23/h1-2,5,8-10,14-15,17-18H,3-4,6-7,11-13,29H2,(H,34,36)(H,31,32,33)/t15-,18?
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 17n/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