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BDBM114648 5-(1-butyl-1,2,3,4-tetrazol-5-yl)-1-(3-imidazol-1-ylpropyl)-5-methyl-pyrrolidin-2-one::5-(1-butyl-5-tetrazolyl)-1-[3-(1-imidazolyl)propyl]-5-methyl-2-pyrrolidinone::5-(1-butyltetrazol-5-yl)-1-(3-imidazol-1-ylpropyl)-5-methyl-2-pyrrolidone::5-(1-butyltetrazol-5-yl)-1-(3-imidazol-1-ylpropyl)-5-methylpyrrolidin-2-one::MLS003552197::SMR002203702::cid_53300809

SMILES: CCCCn1nnnc1C1(C)CCC(=O)N1CCCn1ccnc1

InChI Key: InChIKey=NVZLTUOVCUQQFR-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 = 114648   
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
Methyl-CpG-binding domain protein 2


(Homo sapiens (Human))
BDBM114648
PNG
(5-(1-butyl-1,2,3,4-tetrazol-5-yl)-1-(3-imidazol-1-...)
Show SMILES CCCCn1nnnc1C1(C)CCC(=O)N1CCCn1ccnc1
Show InChI InChI=1S/C16H25N7O/c1-3-4-11-23-15(18-19-20-23)16(2)7-6-14(24)22(16)10-5-9-21-12-8-17-13-21/h8,12-13H,3-7,9-11H2,1-2H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a 4.37E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q20K2778
More data for this
Ligand-Target Pair