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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 282.4
BDBM50400957

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   
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-X-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50400957
PNG
(CHEMBL2205693)
Show SMILES CC1(C)[C@@H]2C[C@H]1C(C[N+]1(C)CCc3ccccc3C1)=CC2 |r,c:21,THB:7:6:4:1|
Show InChI InChI=1S/C20H28N/c1-20(2)18-9-8-17(19(20)12-18)14-21(3)11-10-15-6-4-5-7-16(15)13-21/h4-8,18-19H,9-14H2,1-3H3/q+1/t18-,19-,21?/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
2.51E+3n/an/an/an/an/an/an/an/a



VU University Amsterdam

Curated by ChEMBL


Assay Description
Displacement of [125I]-CXCL10 from human CXCR3 expressed in HEK293 cells


Bioorg Med Chem 19: 3384-93 (2011)


Article DOI: 10.1016/j.bmc.2011.04.035
BindingDB Entry DOI: 10.7270/Q2RB75RG
More data for this
Ligand-Target Pair