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SMILES: Cc1ccccc1S(=O)(=O)N1CCC(CC1)N1CCC(O)(CC1)c1ccc(Cl)cc1

InChI Key: InChIKey=WTSJOVLSWVTJNT-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 = 50374835   
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 1


(Homo sapiens (Human))
BDBM50374835
PNG
(CHEMBL404033)
Show SMILES Cc1ccccc1S(=O)(=O)N1CCC(CC1)N1CCC(O)(CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C23H29ClN2O3S/c1-18-4-2-3-5-22(18)30(28,29)26-14-10-21(11-15-26)25-16-12-23(27,13-17-25)19-6-8-20(24)9-7-19/h2-9,21,27H,10-17H2,1H3
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 180n/an/an/an/an/an/a



Tanabe Research Laboratories USA, Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human CCR1 receptor expressed in THP1 cells assessed as human MIP-1-alpha-stimulated intracellular calcium level by FLIPR assa...


Bioorg Med Chem Lett 18: 2215-21 (2008)


Article DOI: 10.1016/j.bmcl.2007.09.068
BindingDB Entry DOI: 10.7270/Q21C1XQP
More data for this
Ligand-Target Pair
C-C chemokine receptor type 1


(Homo sapiens (Human))
BDBM50374835
PNG
(CHEMBL404033)
Show SMILES Cc1ccccc1S(=O)(=O)N1CCC(CC1)N1CCC(O)(CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C23H29ClN2O3S/c1-18-4-2-3-5-22(18)30(28,29)26-14-10-21(11-15-26)25-16-12-23(27,13-17-25)19-6-8-20(24)9-7-19/h2-9,21,27H,10-17H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 500n/an/an/an/an/an/a



Tanabe Research Laboratories USA, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]MIP1-alpha from human CCR1 receptor expressed in THP1 cells


Bioorg Med Chem Lett 18: 2215-21 (2008)


Article DOI: 10.1016/j.bmcl.2007.09.068
BindingDB Entry DOI: 10.7270/Q21C1XQP
More data for this
Ligand-Target Pair