BDBM50029885 (3aR,7aR)-2-[1-Imino-2-(2-methoxy-phenyl)-ethyl]-7,7-diphenyl-octahydro-isoindol-4-one::2-[1-Imino-2-(2-methoxy-phenyl)-ethyl]-7,7-diphenyl-octahydro-isoindol-4-one::CHEMBL131171::RP 67,580::RP-67580

SMILES COc1ccccc1CC(=N)N1C[C@H]2[C@@H](C1)C(CCC2=O)(c1ccccc1)c1ccccc1

InChI Key InChIKey=VWBOQFANCXZMAU-UHFFFAOYSA-N

Data  3 KI  7 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 10 hits for monomerid = 50029885   

TargetSubstance-P receptor(Rat)
Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50029885(RP-67580 | RP 67,580 | 2-[1-Imino-2-(2-methoxy-phe...)
Affinity DataIC50: 4.16E+3nMAssay Description:Inhibition of [3H]SP binding in rat brain membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetSubstance-P receptor(Guinea pig)
Eli Lilly

Curated by ChEMBL
LigandPNGBDBM50029885(RP-67580 | RP 67,580 | 2-[1-Imino-2-(2-methoxy-phe...)
Affinity DataIC50: 32nMAssay Description:Inhibitory activity against Tachykinin receptor 1 in guinea pig brain using [125I]-labeled Boltan-Hunter substance P as radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetSubstance-P receptor(Rat)
Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50029885(RP-67580 | RP 67,580 | 2-[1-Imino-2-(2-methoxy-phe...)
Affinity DataIC50: 6.70nMAssay Description:Inhibitory activity against Tachykinin receptor 1 in rat brain using [125I]-labeled Boltan-Hunter substance P as radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetSubstance-P receptor(Mouse)
Eli Lilly

Curated by ChEMBL
LigandPNGBDBM50029885(RP-67580 | RP 67,580 | 2-[1-Imino-2-(2-methoxy-phe...)
Affinity DataIC50: 8.70nMAssay Description:Inhibitory activity against Tachykinin receptor 1 in mouse brain using [125I]-labeled Boltan-Hunter substance P as radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetSubstance-P receptor(Human)
Eli Lilly

Curated by ChEMBL
LigandPNGBDBM50029885(RP-67580 | RP 67,580 | 2-[1-Imino-2-(2-methoxy-phe...)
Affinity DataIC50: 30nMAssay Description:Inhibitory activity against Tachykinin receptor 1 in human IM-9 cells using [125I]-labeled Boltan-Hunter substance P as radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetSubstance-P receptor(Human)
Eli Lilly

Curated by ChEMBL
LigandPNGBDBM50029885(RP-67580 | RP 67,580 | 2-[1-Imino-2-(2-methoxy-phe...)
Affinity DataIC50: 49nMAssay Description:Compound was tested for its binding affinity to NK1 receptor in [3H]SP binding assay on human IM9 lymphoblasts cultured cell line.More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/19/2010
Entry Details Article

TargetSubstance-P receptor(Rat)
Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50029885(RP-67580 | RP 67,580 | 2-[1-Imino-2-(2-methoxy-phe...)
Affinity DataIC50: 8nMAssay Description:Compound was tested for its binding affinity to NK1 receptor in [3H]SP binding assay on rat brain membranes.More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/19/2010
Entry Details Article

TargetSubstance-P receptor(Rat)
Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50029885(RP-67580 | RP 67,580 | 2-[1-Imino-2-(2-methoxy-phe...)
Affinity DataKi:  4.20nMAssay Description:Tested for binding affinity towards Tachykinin receptor 1 by using [3H]SP binding assay in rat brain membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/17/2010
Entry Details Article

TargetSubstance-P receptor(Rat)
Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50029885(RP-67580 | RP 67,580 | 2-[1-Imino-2-(2-methoxy-phe...)
Affinity DataKi:  8.29nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/21/2012
Entry Details
PubMed
TargetSubstance-P receptor(Guinea pig)
Eli Lilly

Curated by ChEMBL
LigandPNGBDBM50029885(RP-67580 | RP 67,580 | 2-[1-Imino-2-(2-methoxy-phe...)
Affinity DataKi:  36nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/21/2012
Entry Details
PubMed