BindingDB logo
myBDB logout

BDBM50331374 CHEMBL1290392::N-((3R,4R)-1-methyl-4-(3'-(methylsulfonyl)biphenyl-4-yl)pyrrolidin-3-yl)propane-2-sulfonamide

SMILES: CC(C)S(=O)(=O)N[C@H]1CN(C)C[C@@H]1c1ccc(cc1)-c1cccc(c1)S(C)(=O)=O

InChI Key: InChIKey=VERZXIJVGYAQGS-RTWAWAEBSA-N

Data: 1 IC50  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 2 hits for monomerid = 50331374   
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
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50331374
PNG
(CHEMBL1290392 | N-((3R,4R)-1-methyl-4-(3'-(methyls...)
Show SMILES CC(C)S(=O)(=O)N[C@H]1CN(C)C[C@@H]1c1ccc(cc1)-c1cccc(c1)S(C)(=O)=O |r|
Show InChI InChI=1S/C21H28N2O4S2/c1-15(2)29(26,27)22-21-14-23(3)13-20(21)17-10-8-16(9-11-17)18-6-5-7-19(12-18)28(4,24)25/h5-12,15,20-22H,13-14H2,1-4H3/t20-,21+/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>6.30E+4n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [3H]-dofetilide from human hERG


Bioorg Med Chem Lett 20: 7116-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.09.062
BindingDB Entry DOI: 10.7270/Q2WQ042G
More data for this
Ligand-Target Pair
GRIA2


(Homo sapiens (Human))
BDBM50331374
PNG
(CHEMBL1290392 | N-((3R,4R)-1-methyl-4-(3'-(methyls...)
Show SMILES CC(C)S(=O)(=O)N[C@H]1CN(C)C[C@@H]1c1ccc(cc1)-c1cccc(c1)S(C)(=O)=O |r|
Show InChI InChI=1S/C21H28N2O4S2/c1-15(2)29(26,27)22-21-14-23(3)13-20(21)17-10-8-16(9-11-17)18-6-5-7-19(12-18)28(4,24)25/h5-12,15,20-22H,13-14H2,1-4H3/t20-,21+/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 5.00E+3n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Positive modulation of human GluA2 flip receptor by FLIPR assay


Bioorg Med Chem Lett 20: 7116-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.09.062
BindingDB Entry DOI: 10.7270/Q2WQ042G
More data for this
Ligand-Target Pair