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BDBM173820 US9102591, (+)2-chloro-N-[2-(4-fluorophenyl)-2-[6-(trifluoromethyl)-3-pyridyl]ethyl]benzamide::US9102591, (-)2-chloro-N-[2-(4-fluorophenyl)-2-[6-(trifluoromethyl)-3-pyridyl]ethyl]benzamide::US9649308, (-)2-chloro-N-[2-(4-fluorophenyl)-2-[6-(trifluoromethyl)-3-pyridyl]ethyl]benzamide

SMILES: Fc1ccc(cc1)C(CNC(=O)c1ccccc1Cl)c1ccc(nc1)C(F)(F)F

InChI Key: InChIKey=LMJIEFGCCUMUAV-UHFFFAOYSA-N

Data: 4 IC50

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 4 hits for monomerid = 173820   
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
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM173820
PNG
(US9102591, (+)2-chloro-N-[2-(4-fluorophenyl)-2-[6-...)
Show SMILES Fc1ccc(cc1)C(CNC(=O)c1ccccc1Cl)c1ccc(nc1)C(F)(F)F
Show InChI InChI=1S/C21H15ClF4N2O/c22-18-4-2-1-3-16(18)20(29)28-12-17(13-5-8-15(23)9-6-13)14-7-10-19(27-11-14)21(24,25)26/h1-11,17H,12H2,(H,28,29)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 2.20n/an/an/an/a7.425



H. Lundbeck A/S

US Patent


Assay Description
Fluorescent Imaging Plate Reader (FLIPR) assay: Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), N...


US Patent US9102591 (2015)


BindingDB Entry DOI: 10.7270/Q2028Q92
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM173820
PNG
(US9102591, (+)2-chloro-N-[2-(4-fluorophenyl)-2-[6-...)
Show SMILES Fc1ccc(cc1)C(CNC(=O)c1ccccc1Cl)c1ccc(nc1)C(F)(F)F
Show InChI InChI=1S/C21H15ClF4N2O/c22-18-4-2-1-3-16(18)20(29)28-12-17(13-5-8-15(23)9-6-13)14-7-10-19(27-11-14)21(24,25)26/h1-11,17H,12H2,(H,28,29)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 3.10n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
Fluorescent Imaging Plate Reader (FLIPR) assay: Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), N...


US Patent US9649308 (2017)


BindingDB Entry DOI: 10.7270/Q2BG2R29
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM173820
PNG
(US9102591, (+)2-chloro-N-[2-(4-fluorophenyl)-2-[6-...)
Show SMILES Fc1ccc(cc1)C(CNC(=O)c1ccccc1Cl)c1ccc(nc1)C(F)(F)F
Show InChI InChI=1S/C21H15ClF4N2O/c22-18-4-2-1-3-16(18)20(29)28-12-17(13-5-8-15(23)9-6-13)14-7-10-19(27-11-14)21(24,25)26/h1-11,17H,12H2,(H,28,29)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 2.20n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
Fluorescent Imaging Plate Reader (FLIPR) assay: Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), N...


US Patent US9649308 (2017)


BindingDB Entry DOI: 10.7270/Q2BG2R29
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM173820
PNG
(US9102591, (+)2-chloro-N-[2-(4-fluorophenyl)-2-[6-...)
Show SMILES Fc1ccc(cc1)C(CNC(=O)c1ccccc1Cl)c1ccc(nc1)C(F)(F)F
Show InChI InChI=1S/C21H15ClF4N2O/c22-18-4-2-1-3-16(18)20(29)28-12-17(13-5-8-15(23)9-6-13)14-7-10-19(27-11-14)21(24,25)26/h1-11,17H,12H2,(H,28,29)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 3.10n/an/an/an/a7.425



H. Lundbeck A/S

US Patent


Assay Description
Fluorescent Imaging Plate Reader (FLIPR) assay: Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), N...


US Patent US9102591 (2015)


BindingDB Entry DOI: 10.7270/Q2028Q92
More data for this
Ligand-Target Pair