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SMILES: OC1(CCN(CCCNS(=O)(=O)c2ccccc2)CC1)c1ccc(Cl)cc1

InChI Key: InChIKey=VHKQMVRYKPZJFI-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50374804   
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))
BDBM50374804
PNG
(CHEMBL270631)
Show SMILES OC1(CCN(CCCNS(=O)(=O)c2ccccc2)CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H25ClN2O3S/c21-18-9-7-17(8-10-18)20(24)11-15-23(16-12-20)14-4-13-22-27(25,26)19-5-2-1-3-6-19/h1-3,5-10,22,24H,4,11-16H2
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 90n/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))
BDBM50374804
PNG
(CHEMBL270631)
Show SMILES OC1(CCN(CCCNS(=O)(=O)c2ccccc2)CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H25ClN2O3S/c21-18-9-7-17(8-10-18)20(24)11-15-23(16-12-20)14-4-13-22-27(25,26)19-5-2-1-3-6-19/h1-3,5-10,22,24H,4,11-16H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 300n/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