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BDBM95659 2-(2,4-diketo-6-methyl-1,3-diazaspiro[4.5]decan-3-yl)-N-[2-(4-methoxyphenyl)ethyl]acetamide::MLS002245615::N-[2-(4-methoxyphenyl)ethyl]-2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide::N-[2-(4-methoxyphenyl)ethyl]-2-[6-methyl-2,4-bis(oxidanylidene)-1,3-diazaspiro[4.5]decan-3-yl]ethanamide::SMR001309260::cid_3279586

SMILES: COc1ccc(CCNC(=O)CN2C(=O)NC3(CCCCC3C)C2=O)cc1

InChI Key: InChIKey=XKUYPKJDCSJEHV-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 95659   
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
nuclear receptor subfamily 5 group A member 2 isoform 2


(Homo sapiens (human))
BDBM95659
PNG
(2-(2,4-diketo-6-methyl-1,3-diazaspiro[4.5]decan-3-...)
Show SMILES COc1ccc(CCNC(=O)CN2C(=O)NC3(CCCCC3C)C2=O)cc1
Show InChI InChI=1S/C20H27N3O4/c1-14-5-3-4-11-20(14)18(25)23(19(26)22-20)13-17(24)21-12-10-15-6-8-16(27-2)9-7-15/h6-9,14H,3-5,10-13H2,1-2H3,(H,21,24)(H,22,26)
PDB
MMDB

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PC sid
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Similars

PCBioAssay
n/an/a 1.31E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q22F7M18
More data for this
Ligand-Target Pair