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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'C-C chemokine receptor type 3' and Ligand = 'BDBM50387665'   
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 3


(Homo sapiens (Human))
BDBM50387665
PNG
(CHEMBL2058070)
Show SMILES Fc1ccc2cc(CN3[C@@H]4CC[C@@H]3CC(C4)NC(=O)N3CCC[C@H]3C(=O)Nc3ccccc3Cl)ccc2c1 |r,TLB:7:8:14.15.13:10.11,16:14:8:10.11|
Show InChI InChI=1S/C30H32ClFN4O2/c31-26-4-1-2-5-27(26)34-29(37)28-6-3-13-35(28)30(38)33-23-16-24-11-12-25(17-23)36(24)18-19-7-8-21-15-22(32)10-9-20(21)14-19/h1-2,4-5,7-10,14-15,23-25,28H,3,6,11-13,16-18H2,(H,33,38)(H,34,37)/t24-,25-,28+/m1/s1
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Article
PubMed
n/an/a 29n/an/an/an/an/an/a



Toray Industries, Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human CCR3


Bioorg Med Chem Lett 22: 4951-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.042
BindingDB Entry DOI: 10.7270/Q2057H06
More data for this
Ligand-Target Pair