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BDBM50409951 CHEMBL2096789

SMILES: FC(F)(F)c1cccc(c1)C(=O)NCC(=O)N[C@H]1CCN(Cc2ccc(Cl)cc2)C1

InChI Key: InChIKey=BAOQJSULMWXFRK-SFHVURJKSA-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 = 50409951   
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))
BDBM50409951
PNG
(CHEMBL2096789)
Show SMILES FC(F)(F)c1cccc(c1)C(=O)NCC(=O)N[C@H]1CCN(Cc2ccc(Cl)cc2)C1 |r|
Show InChI InChI=1S/C21H21ClF3N3O2/c22-17-6-4-14(5-7-17)12-28-9-8-18(13-28)27-19(29)11-26-20(30)15-2-1-3-16(10-15)21(23,24)25/h1-7,10,18H,8-9,11-13H2,(H,26,30)(H,27,29)/t18-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.20E+3n/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
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50409951
PNG
(CHEMBL2096789)
Show SMILES FC(F)(F)c1cccc(c1)C(=O)NCC(=O)N[C@H]1CCN(Cc2ccc(Cl)cc2)C1 |r|
Show InChI InChI=1S/C21H21ClF3N3O2/c22-17-6-4-14(5-7-17)12-28-9-8-18(13-28)27-19(29)11-26-20(30)15-2-1-3-16(10-15)21(23,24)25/h1-7,10,18H,8-9,11-13H2,(H,26,30)(H,27,29)/t18-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 360n/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