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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for UniProtKB: Q9EQ16   
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
C-X-C chemokine receptor type 6


(Mus musculus)
BDBM50539457
PNG
(CHEMBL4645971)
Show SMILES [H][C@]12CCC[C@]([H])(C[C@H](C1)NC(=O)c1cc(OC)c(OC)c(OC)c1)N2CC(=O)Nc1ccccc1Cl |r,TLB:10:8:25:4.2.3|
Show InChI InChI=1S/C26H32ClN3O5/c1-33-22-11-16(12-23(34-2)25(22)35-3)26(32)28-17-13-18-7-6-8-19(14-17)30(18)15-24(31)29-21-10-5-4-9-20(21)27/h4-5,9-12,17-19H,6-8,13-15H2,1-3H3,(H,28,32)(H,29,31)/t17-,18-,19+
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MCE
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.80E+4n/an/an/an/an/an/a



Sanford Burnham Prebys Medical Discovery Institute

Curated by ChEMBL


Assay Description
Antagonist activity at mouse CXCR6 by DiscoveRx cell based beta-arrestin assay


Bioorg Med Chem Lett 30: (2020)


Article DOI: 10.1016/j.bmcl.2019.126899
BindingDB Entry DOI: 10.7270/Q2K077T6
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 6


(Mus musculus)
BDBM50539483
PNG
(CHEMBL4637126)
Show SMILES [H][C@]12CCC[C@]([H])(C[C@H](C1)NC(=O)c1cc(OC)c(OC)c(OC)c1)N2Cc1nc2c(cccc2s1)C(F)(F)F |r,TLB:10:8:25:4.2.3|
Show InChI InChI=1S/C27H30F3N3O4S/c1-35-20-10-15(11-21(36-2)25(20)37-3)26(34)31-16-12-17-6-4-7-18(13-16)33(17)14-23-32-24-19(27(28,29)30)8-5-9-22(24)38-23/h5,8-11,16-18H,4,6-7,12-14H2,1-3H3,(H,31,34)/t16-,17-,18+
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UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>4.00E+4n/an/an/an/an/an/a



Sanford Burnham Prebys Medical Discovery Institute

Curated by ChEMBL


Assay Description
Antagonist activity at mouse CXCR6 by DiscoveRx cell based beta-arrestin assay


Bioorg Med Chem Lett 30: (2020)


Article DOI: 10.1016/j.bmcl.2019.126899
BindingDB Entry DOI: 10.7270/Q2K077T6
More data for this
Ligand-Target Pair