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BDBM50153938 CHEMBL181432::N-{[1-(4-Chloro-benzyl)-piperidin-3-ylcarbamoyl]-methyl}-3-trifluoromethyl-benzamide

SMILES: FC(F)(F)c1cccc(c1)C(=O)NCC(=O)NC1CCCN(Cc2ccc(Cl)cc2)C1

InChI Key: InChIKey=WUTHMLMEUBCLDN-UHFFFAOYSA-N

Data: 1 IC50  1 EC50

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 = 50153938   
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 2


(Homo sapiens (Human))
BDBM50153938
PNG
(CHEMBL181432 | N-{[1-(4-Chloro-benzyl)-piperidin-3...)
Show SMILES FC(F)(F)c1cccc(c1)C(=O)NCC(=O)NC1CCCN(Cc2ccc(Cl)cc2)C1
Show InChI InChI=1S/C22H23ClF3N3O2/c23-18-8-6-15(7-9-18)13-29-10-2-5-19(14-29)28-20(30)12-27-21(31)16-3-1-4-17(11-16)22(24,25)26/h1,3-4,6-9,11,19H,2,5,10,12-14H2,(H,27,31)(H,28,30)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 610n/an/an/an/a



Deltagen Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of MCP-1 induced chemotaxis in THP-1 cells


Bioorg Med Chem Lett 14: 5413-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.08.009
BindingDB Entry DOI: 10.7270/Q2W958PZ
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50153938
PNG
(CHEMBL181432 | N-{[1-(4-Chloro-benzyl)-piperidin-3...)
Show SMILES FC(F)(F)c1cccc(c1)C(=O)NCC(=O)NC1CCCN(Cc2ccc(Cl)cc2)C1
Show InChI InChI=1S/C22H23ClF3N3O2/c23-18-8-6-15(7-9-18)13-29-10-2-5-19(14-29)28-20(30)12-27-21(31)16-3-1-4-17(11-16)22(24,25)26/h1,3-4,6-9,11,19H,2,5,10,12-14H2,(H,27,31)(H,28,30)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 660n/an/an/an/an/an/a



Deltagen Research Laboratories

Curated by ChEMBL


Assay Description
Concentration required to inhibit [125I]-MCP-1 binding to Chemokine receptor 2B


Bioorg Med Chem Lett 14: 5413-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.08.009
BindingDB Entry DOI: 10.7270/Q2W958PZ
More data for this
Ligand-Target Pair