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BDBM50387655 CHEMBL2057757

SMILES: Fc1ccc2cc(CN3[C@@H]4CC[C@@H]3CC(C4)NC(=O)N3CCN(CC3)C(=O)c3c(Cl)cccc3Cl)ccc2c1

InChI Key: InChIKey=JKTDSWBPQGRDKI-ISIPKWIHNA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50387655   
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-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50387655
PNG
(CHEMBL2057757)
Show SMILES Fc1ccc2cc(CN3[C@@H]4CC[C@@H]3CC(C4)NC(=O)N3CCN(CC3)C(=O)c3c(Cl)cccc3Cl)ccc2c1
Show InChI InChI=1/C30H31Cl2FN4O2/c31-26-2-1-3-27(32)28(26)29(38)35-10-12-36(13-11-35)30(39)34-23-16-24-8-9-25(17-23)37(24)18-19-4-5-21-15-22(33)7-6-20(21)14-19/h1-7,14-15,23-25H,8-13,16-18H2,(H,34,39)/t24-,25-/s2
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.60E+3n/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