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BDBM332579 (2E)-3-(3,4-dichlorophenyl)-1-(7-{[3-fluoro-4-(trifluoromethyl)phenyl]methyl}-2,7-diazaspiro[3.5]non-2-yl)prop-2-en-1-one::US10196369, Compound C34

SMILES: Fc1cc(CN2CCC3(CN(C3)C(=O)\C=C\c3ccc(Cl)c(Cl)c3)CC2)ccc1C(F)(F)F

InChI Key: InChIKey=FGENYZIUQVDDAD-ZZXKWVIFSA-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 = 332579   
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))
BDBM332579
PNG
((2E)-3-(3,4-dichlorophenyl)-1-(7-{[3-fluoro-4-(tri...)
Show SMILES Fc1cc(CN2CCC3(CN(C3)C(=O)\C=C\c3ccc(Cl)c(Cl)c3)CC2)ccc1C(F)(F)F
Show InChI InChI=1S/C24H22Cl2F4N2O/c25-19-5-2-16(11-20(19)26)3-6-22(33)32-14-23(15-32)7-9-31(10-8-23)13-17-1-4-18(21(27)12-17)24(28,29)30/h1-6,11-12H,7-10,13-15H2/b6-3+
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