BDBM50113263 (S)-1-[4-(4-benzhydrylthiosemicarbazido)-3-nitrobenzenesulfonyl]pyrrolidine-2-carboxylic acid{2-[(2-dimethylaminoethyl)methylamino]ethyl}amide(bradyzide)::CHEMBL308468::CHEMBL431562

SMILES CN(C)CCN(C)CCNC(=O)C1CCCN1S(=O)(=O)c1ccc(N[N-]C(=[SH+])NC(c2ccccc2)c2ccccc2)c(c1)[N+]([O-])=O

InChI Key InChIKey=YTMVYGCOMYSEFL-UHFFFAOYSA-N

Data  4 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50113263   

TargetB2 bradykinin receptor(Rat)
Novartis Institute For Medical Sciences

Curated by ChEMBL
LigandPNGBDBM50113263(CHEMBL308468 | CHEMBL431562 | (S)-1-[4-(4-benzhydr...)
Affinity DataKi:  0.5nMAssay Description:Inhibition of specific binding of [3H]-BK (1 nM) to rat Bradykinin receptor B2 by 50% in NG108-15 cell membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/26/2012
Entry Details Article
PubMed
TargetB2 bradykinin receptor(Rat)
Novartis Institute For Medical Sciences

Curated by ChEMBL
LigandPNGBDBM50113263(CHEMBL308468 | CHEMBL431562 | (S)-1-[4-(4-benzhydr...)
Affinity DataKi:  0.600nMAssay Description:Inhibition of specific binding of [3H]-BK (1 nM) to rat Bradykinin receptor B2 by 50% in NG108-15 cell membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/26/2012
Entry Details Article
PubMed
TargetB2 bradykinin receptor(Human)
Novartis Institute For Medical Sciences

Curated by ChEMBL
LigandPNGBDBM50113263(CHEMBL308468 | CHEMBL431562 | (S)-1-[4-(4-benzhydr...)
Affinity DataKi:  772nMAssay Description:Displacement of [3H]BK (1 nM) from human Bradykinin receptor B2 expressed in Cos-7 cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/26/2012
Entry Details Article
PubMed
TargetB2 bradykinin receptor(Human)
Novartis Institute For Medical Sciences

Curated by ChEMBL
LigandPNGBDBM50113263(CHEMBL308468 | CHEMBL431562 | (S)-1-[4-(4-benzhydr...)
Affinity DataKi:  1.43E+3nMAssay Description:Displacement of [3H]BK (1 nM) from human Bradykinin receptor B2 expressed in Cos-7 cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/26/2012
Entry Details Article
PubMed