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BDBM141515 US8921373, ACU

SMILES: COC1CN(CCN1C(=O)Nc1nc2ccc(F)cc2s1)c1ncc(C[C@@H](O)CO)cc1Cl

InChI Key: InChIKey=UCVYUQYQRCZBGK-IKJXHCRLSA-N

Data: 1 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 1 hit for monomerid = 141515   
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))
BDBM141515
PNG
(US8921373, ACU)
Show SMILES COC1CN(CCN1C(=O)Nc1nc2ccc(F)cc2s1)c1ncc(C[C@@H](O)CO)cc1Cl |r|
Show InChI InChI=1S/C21H23ClFN5O4S/c1-32-18-10-27(19-15(22)7-12(9-24-19)6-14(30)11-29)4-5-28(18)21(31)26-20-25-16-3-2-13(23)8-17(16)33-20/h2-3,7-9,14,18,29-30H,4-6,10-11H2,1H3,(H,25,26,31)/t14-,18?/m1/s1
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MMDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 1n/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