BindingDB logo
myBDB logout

BDBM84194 (4-{5-[1-(3-Chloro-benzenesulfonyl)-piperidin-4-yl]-[1,2,4]oxadiazol-3-yl}-phenyl)-dimethyl-amine::4-[5-[1-(3-chlorophenyl)sulfonyl-4-piperidinyl]-1,2,4-oxadiazol-3-yl]-N,N-dimethylaniline::4-[5-[1-(3-chlorophenyl)sulfonylpiperidin-4-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-aniline::4-[5-[1-(3-chlorophenyl)sulfonylpiperidin-4-yl]-1,2,4-oxadiazol-3-yl]-N,N-dimethylaniline::MLS000076295::SMR000007431::[4-[5-[1-(3-chlorophenyl)sulfonyl-4-piperidyl]-1,2,4-oxadiazol-3-yl]phenyl]-dimethyl-amine::cid_651592

SMILES: CN(C)c1ccc(cc1)-c1noc(n1)C1CCN(CC1)S(=O)(=O)c1cccc(Cl)c1

InChI Key: InChIKey=AHJLESCWKWSVKL-UHFFFAOYSA-N

Data: 1 EC50

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 = 84194   
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
Adrenergic receptor


(Homo sapiens (Human))
BDBM84194
PNG
((4-{5-[1-(3-Chloro-benzenesulfonyl)-piperidin-4-yl...)
Show SMILES CN(C)c1ccc(cc1)-c1noc(n1)C1CCN(CC1)S(=O)(=O)c1cccc(Cl)c1
Show InChI InChI=1S/C21H23ClN4O3S/c1-25(2)18-8-6-15(7-9-18)20-23-21(29-24-20)16-10-12-26(13-11-16)30(27,28)19-5-3-4-17(22)14-19/h3-9,14,16H,10-13H2,1-2H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 1.23E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: R03 MH093192-01 Project Title: HTS for Non-Canonical Ligands for Beta 2 Adrenergic Receptor...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2RB734K
More data for this
Ligand-Target Pair