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SMILES: Clc1ccc(OC2CCN(CC2)C2CCN(CC2)C(=O)NS(=O)(=O)Cc2ccccc2)cc1Cl

InChI Key: InChIKey=SHRVEEBUQYOBLS-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50397491   
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
Histamine H1 receptor


(Homo sapiens (Human))
BDBM50397491
PNG
(CHEMBL2171215)
Show SMILES Clc1ccc(OC2CCN(CC2)C2CCN(CC2)C(=O)NS(=O)(=O)Cc2ccccc2)cc1Cl
Show InChI InChI=1S/C24H29Cl2N3O4S/c25-22-7-6-21(16-23(22)26)33-20-10-14-28(15-11-20)19-8-12-29(13-9-19)24(30)27-34(31,32)17-18-4-2-1-3-5-18/h1-7,16,19-20H,8-15,17H2,(H,27,30)
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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
50.1n/an/an/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Displacement of [3H]pyrilamine from human H1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 22: 6688-93 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.124
BindingDB Entry DOI: 10.7270/Q2QF8V00
More data for this
Ligand-Target Pair
C-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50397491
PNG
(CHEMBL2171215)
Show SMILES Clc1ccc(OC2CCN(CC2)C2CCN(CC2)C(=O)NS(=O)(=O)Cc2ccccc2)cc1Cl
Show InChI InChI=1S/C24H29Cl2N3O4S/c25-22-7-6-21(16-23(22)26)33-20-10-14-28(15-11-20)19-8-12-29(13-9-19)24(30)27-34(31,32)17-18-4-2-1-3-5-18/h1-7,16,19-20H,8-15,17H2,(H,27,30)
PDB

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UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
158n/an/an/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Binding affinity to human CCR3 receptor expressed in CHOK1 cells by radioligand displacement assay


Bioorg Med Chem Lett 22: 6688-93 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.124
BindingDB Entry DOI: 10.7270/Q2QF8V00
More data for this
Ligand-Target Pair