BDBM50097727 (S)-1-{N'-[4-(2-Methylsulfanyl-ethylsulfamoyl)-2-nitro-phenyl]-hydrazinothiocarbonyl}-pyrrolidine-2-carboxylic acid benzhydryl-amide::CHEMBL163510::CHEMBL351059

SMILES CSCCNS(=O)(=O)c1ccc(N[N-]C(=[SH+])N2CCCC2C(=O)NC(c2ccccc2)c2ccccc2)c(c1)[N+]([O-])=O

InChI Key InChIKey=OOHMYZYAQYLRQK-UHFFFAOYSA-N

Data  6 IC50

  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 6 hits for monomerid = 50097727   

TargetB2 bradykinin receptor(RAT)
Novartis Institute For Medical Sciences

Curated by ChEMBL
LigandPNGBDBM50097727((S)-1-{N'-[4-(2-Methylsulfanyl-ethylsulfamoyl)-2-n...)
Affinity DataIC50: >1.00E+5nMAssay Description:In vitro binding affinity against Bradykinin receptor B2 in rat NG 108-15 neuroblastoma-glioma hybrid cell membranes using [3H]BK binding assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSubstance-P receptor(Homo sapiens (Human))
Novartis Institute For Medical Sciences

Curated by ChEMBL
LigandPNGBDBM50097727((S)-1-{N'-[4-(2-Methylsulfanyl-ethylsulfamoyl)-2-n...)
Affinity DataIC50:  7.93E+3nMAssay Description:In vitro binding affinity against Tachykinin receptor 1 in guinea pig ileum using organ bath assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetB2 bradykinin receptor(RAT)
Novartis Institute For Medical Sciences

Curated by ChEMBL
LigandPNGBDBM50097727((S)-1-{N'-[4-(2-Methylsulfanyl-ethylsulfamoyl)-2-n...)
Affinity DataIC50: >1.00E+5nMAssay Description:In vitro binding affinity against Bradykinin receptor B2 in rat NG 108-15 neuroblastoma-glioma hybrid cell membranes using [3H]BK binding assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSubstance-P receptor(GUINEA PIG)
Novartis Institute For Medical Sciences

Curated by ChEMBL
LigandPNGBDBM50097727((S)-1-{N'-[4-(2-Methylsulfanyl-ethylsulfamoyl)-2-n...)
Affinity DataIC50:  7.93E+3nMAssay Description:In vitro binding affinity against Tachykinin receptor 1 in guinea pig ileum using organ bath assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSubstance-P receptor(Homo sapiens (Human))
Novartis Institute For Medical Sciences

Curated by ChEMBL
LigandPNGBDBM50097727((S)-1-{N'-[4-(2-Methylsulfanyl-ethylsulfamoyl)-2-n...)
Affinity DataIC50: >5.00E+4nMAssay Description:In vitro binding affinity against Tachykinin receptor 1 in rabbit whole brain membranes using [3H][Sar9Met(O2)]-SP binding assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSubstance-P receptor(GUINEA PIG)
Novartis Institute For Medical Sciences

Curated by ChEMBL
LigandPNGBDBM50097727((S)-1-{N'-[4-(2-Methylsulfanyl-ethylsulfamoyl)-2-n...)
Affinity DataIC50:  980nMAssay Description:In vitro binding affinity against Tachykinin receptor 1 in guinea pig ileum using organ bath assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed