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SMILES: C[C@H](CN1C2CCC1CC(Cc1ccc(Cl)cc1)C2)NC(=O)Nc1cccc(c1)S(C)(=O)=O

InChI Key: InChIKey=QDNRONLZDDMDPZ-UINAOQCUSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50133789   
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))
BDBM50133789
PNG
(1-{(R)-2-[3-(4-Chloro-benzyl)-8-aza-bicyclo[3.2.1]...)
Show SMILES C[C@H](CN1C2CCC1CC(Cc1ccc(Cl)cc1)C2)NC(=O)Nc1cccc(c1)S(C)(=O)=O |THB:10:9:3:5.6|
Show InChI InChI=1S/C25H32ClN3O3S/c1-17(27-25(30)28-21-4-3-5-24(15-21)33(2,31)32)16-29-22-10-11-23(29)14-19(13-22)12-18-6-8-20(26)9-7-18/h3-9,15,17,19,22-23H,10-14,16H2,1-2H3,(H2,27,28,30)/t17-,19?,22?,23?/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 65n/an/an/an/an/an/a



Roche Palo Alto

Curated by ChEMBL


Assay Description
Binding affinity was determined towards C-C chemokine receptor type 3 using [125I]-labeled eotaxin as radioligand


Bioorg Med Chem Lett 13: 3597-600 (2003)


BindingDB Entry DOI: 10.7270/Q228085J
More data for this
Ligand-Target Pair
C-C chemokine receptor type 3


(Homo sapiens (Human))
BDBM50133789
PNG
(1-{(R)-2-[3-(4-Chloro-benzyl)-8-aza-bicyclo[3.2.1]...)
Show SMILES C[C@H](CN1C2CCC1CC(Cc1ccc(Cl)cc1)C2)NC(=O)Nc1cccc(c1)S(C)(=O)=O |THB:10:9:3:5.6|
Show InChI InChI=1S/C25H32ClN3O3S/c1-17(27-25(30)28-21-4-3-5-24(15-21)33(2,31)32)16-29-22-10-11-23(29)14-19(13-22)12-18-6-8-20(26)9-7-18/h3-9,15,17,19,22-23H,10-14,16H2,1-2H3,(H2,27,28,30)/t17-,19?,22?,23?/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 12n/an/an/an/an/an/a



Roche Palo Alto

Curated by ChEMBL


Assay Description
Compound was tested for its ability to inhibit C-C chemokine receptor type 3 receptor


Bioorg Med Chem Lett 13: 3597-600 (2003)


BindingDB Entry DOI: 10.7270/Q228085J
More data for this
Ligand-Target Pair