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BDBM141518 US8921373, 5::US9365563, 204::US9878991, Compound 204

SMILES: FC(F)(F)c1ccc(NC(=O)N2CCC(F)(CC2)c2ncccc2Cl)nc1

InChI Key: InChIKey=VWPACZUSCZWKKR-UHFFFAOYSA-N

Data: 5 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 5 hits for monomerid = 141518   
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
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM141518
PNG
(US8921373, 5 | US9365563, 204 | US9878991, Compoun...)
Show SMILES FC(F)(F)c1ccc(NC(=O)N2CCC(F)(CC2)c2ncccc2Cl)nc1
Show InChI InChI=1S/C17H15ClF4N4O/c18-12-2-1-7-23-14(12)16(19)5-8-26(9-6-16)15(27)25-13-4-3-11(10-24-13)17(20,21)22/h1-4,7,10H,5-6,8-9H2,(H,24,25,27)
PDB
MMDB

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UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
n/an/a 154n/an/an/an/a7.4n/a



Shionogi & Co., Ltd.

US Patent


Assay Description
Two days prior to performing this assay, cells are seeded on poly-D-lysine-coated 96-well clear-bottom black plates (commercially available from Bect...


US Patent US8921373 (2014)


BindingDB Entry DOI: 10.7270/Q28051BW
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM141518
PNG
(US8921373, 5 | US9365563, 204 | US9878991, Compoun...)
Show SMILES FC(F)(F)c1ccc(NC(=O)N2CCC(F)(CC2)c2ncccc2Cl)nc1
Show InChI InChI=1S/C17H15ClF4N4O/c18-12-2-1-7-23-14(12)16(19)5-8-26(9-6-16)15(27)25-13-4-3-11(10-24-13)17(20,21)22/h1-4,7,10H,5-6,8-9H2,(H,24,25,27)
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PC sid
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US Patent
n/an/a 167n/an/an/an/a7.4n/a



Purdue Pharma L.P.

US Patent


Assay Description
Two days prior to performing this assay, cells are seeded in poly-D-lysine-coated 96-well clear-bottom black plates (50,000 cells/well) in growth med...


US Patent US9365563 (2016)


BindingDB Entry DOI: 10.7270/Q2P26X1D
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM141518
PNG
(US8921373, 5 | US9365563, 204 | US9878991, Compoun...)
Show SMILES FC(F)(F)c1ccc(NC(=O)N2CCC(F)(CC2)c2ncccc2Cl)nc1
Show InChI InChI=1S/C17H15ClF4N4O/c18-12-2-1-7-23-14(12)16(19)5-8-26(9-6-16)15(27)25-13-4-3-11(10-24-13)17(20,21)22/h1-4,7,10H,5-6,8-9H2,(H,24,25,27)
PDB
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PC sid
UniChem
US Patent
n/an/a 154n/an/an/an/a7.4n/a



Purdue Pharma L.P.

US Patent


Assay Description
Two days prior to performing this assay, cells are seeded on poly-D-lysine-coated 96-well clear-bottom black plates (commercially available from Bect...


US Patent US9878991 (2018)


BindingDB Entry DOI: 10.7270/Q2TF00CG
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM141518
PNG
(US8921373, 5 | US9365563, 204 | US9878991, Compoun...)
Show SMILES FC(F)(F)c1ccc(NC(=O)N2CCC(F)(CC2)c2ncccc2Cl)nc1
Show InChI InChI=1S/C17H15ClF4N4O/c18-12-2-1-7-23-14(12)16(19)5-8-26(9-6-16)15(27)25-13-4-3-11(10-24-13)17(20,21)22/h1-4,7,10H,5-6,8-9H2,(H,24,25,27)
PDB
MMDB

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UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
n/an/a 167n/an/an/an/a7.4n/a



Purdue Pharma L.P.

US Patent


Assay Description
Two days prior to performing this assay, cells are seeded in poly-D-lysine-coated 96-well clear-bottom black plates (50,000 cells/well) in growth med...


US Patent US9878991 (2018)


BindingDB Entry DOI: 10.7270/Q2TF00CG
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM141518
PNG
(US8921373, 5 | US9365563, 204 | US9878991, Compoun...)
Show SMILES FC(F)(F)c1ccc(NC(=O)N2CCC(F)(CC2)c2ncccc2Cl)nc1
Show InChI InChI=1S/C17H15ClF4N4O/c18-12-2-1-7-23-14(12)16(19)5-8-26(9-6-16)15(27)25-13-4-3-11(10-24-13)17(20,21)22/h1-4,7,10H,5-6,8-9H2,(H,24,25,27)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 154n/an/an/an/a7.4n/a



Purdue Pharma L.P.

US Patent


Assay Description
Two days prior to performing this assay, cells are seeded on poly-D-lysine-coated 96-well clear-bottom black plates (commercially available from Bect...


US Patent US9365563 (2016)


BindingDB Entry DOI: 10.7270/Q2P26X1D
More data for this
Ligand-Target Pair