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BDBM332572 (2E)-3-(4-bromophenyl)-1-(7-{[4-fluoro-3-(trifluoromethyl)phenyl]methyl}-2,7-diazaspiro[3.5]non-2-yl)prop-2-en-1-one::US10196369, Compound C27

SMILES: Fc1ccc(CN2CCC3(CN(C3)C(=O)\C=C\c3ccc(Br)cc3)CC2)cc1C(F)(F)F

InChI Key: InChIKey=UGRHJGONDLBVQQ-XBXARRHUSA-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 = 332572   
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
G-protein coupled receptor 183


(Homo sapiens (Human))
BDBM332572
PNG
((2E)-3-(4-bromophenyl)-1-(7-{[4-fluoro-3-(trifluor...)
Show SMILES Fc1ccc(CN2CCC3(CN(C3)C(=O)\C=C\c3ccc(Br)cc3)CC2)cc1C(F)(F)F
Show InChI InChI=1S/C24H23BrF4N2O/c25-19-5-1-17(2-6-19)4-8-22(32)31-15-23(16-31)9-11-30(12-10-23)14-18-3-7-21(26)20(13-18)24(27,28)29/h1-8,13H,9-12,14-16H2/b8-4+
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 12.5n/an/an/an/an/an/a



SANFORD BURNHAM PREBYS MEDICAL DISCOVERY INSTITUTE

US Patent


Assay Description
The test compounds that demonstrated a corrected % activity of >=50% were defined as inhibitors of the reaction. The experimental values were normali...


US Patent US10196369 (2019)

More data for this
Ligand-Target Pair