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BDBM332578 (2E)-3-(3,4-dichlorophenyl)-1-{7-[(4-chlorophenyl)methyl]-2,7-diazaspiro[3.5]non-2-yl}prop-2-en-1-one::US10196369, Compound C33

SMILES: Clc1ccc(CN2CCC3(CN(C3)C(=O)\C=C\c3ccc(Cl)c(Cl)c3)CC2)cc1

InChI Key: InChIKey=QTZFDFHEXBQYEE-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 = 332578   
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))
BDBM332578
PNG
((2E)-3-(3,4-dichlorophenyl)-1-{7-[(4-chlorophenyl)...)
Show SMILES Clc1ccc(CN2CCC3(CN(C3)C(=O)\C=C\c3ccc(Cl)c(Cl)c3)CC2)cc1
Show InChI InChI=1S/C23H23Cl3N2O/c24-19-5-1-18(2-6-19)14-27-11-9-23(10-12-27)15-28(16-23)22(29)8-4-17-3-7-20(25)21(26)13-17/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