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BDBM50211531 (3S,4R)-3-hydroxy-2,2-dimethyl-4-(4-nitrophenylsulfonamido)-N-phenethylchroman-6-carboxamide::CHEMBL394848

SMILES: CC1(C)Oc2ccc(cc2[C@@H](NS(=O)(=O)c2ccc(cc2)[N+]([O-])=O)[C@@H]1O)C(=O)NCCc1ccccc1

InChI Key: InChIKey=KVYYCMFVDQMOEJ-RPWUZVMVSA-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 = 50211531   
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 A member 5


(Homo sapiens (Human))
BDBM50211531
PNG
((3S,4R)-3-hydroxy-2,2-dimethyl-4-(4-nitrophenylsul...)
Show SMILES CC1(C)Oc2ccc(cc2[C@@H](NS(=O)(=O)c2ccc(cc2)[N+]([O-])=O)[C@@H]1O)C(=O)NCCc1ccccc1
Show InChI InChI=1S/C26H27N3O7S/c1-26(2)24(30)23(28-37(34,35)20-11-9-19(10-12-20)29(32)33)21-16-18(8-13-22(21)36-26)25(31)27-15-14-17-6-4-3-5-7-17/h3-13,16,23-24,28,30H,14-15H2,1-2H3,(H,27,31)/t23-,24+/m1/s1
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PC sid
UniChem

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Similars

Article
PubMed
n/an/a>1.00E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells


Bioorg Med Chem Lett 17: 3271-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.04.020
BindingDB Entry DOI: 10.7270/Q2S75G0V
More data for this
Ligand-Target Pair