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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 417.4
BDBM50203874

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-C chemokine receptor type 8


(Homo sapiens (Human))
BDBM50203874
PNG
(CHEMBL385287 | N-{4-[(pyridin-4-ylmethyl)-sulfamoy...)
Show SMILES O=C(Nc1ccc(c2ccccc12)S(=O)(=O)NCc1ccncc1)c1ccccc1
Show InChI InChI=1S/C23H19N3O3S/c27-23(18-6-2-1-3-7-18)26-21-10-11-22(20-9-5-4-8-19(20)21)30(28,29)25-16-17-12-14-24-15-13-17/h1-15,25H,16H2,(H,26,27)
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Similars

Article
PubMed
3.28E+3n/an/an/an/an/an/an/an/a



Millennium Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity to human CCR8 expressed in L1.2 cells by FMAT assay


J Med Chem 50: 566-84 (2007)


Article DOI: 10.1021/jm061118e
BindingDB Entry DOI: 10.7270/Q24J0DSN
More data for this
Ligand-Target Pair