BDBM50330860 CHEMBL1201356::METHYLERGONOVINE::Methylergometrine

SMILES CC[C@@H](CO)NC(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4c3c(ccc4)C2=C1)C

InChI Key InChIKey=UNBRKDKAWYKMIV-UHFFFAOYSA-N

Data  10 KI  1 IC50

PDB links: 2 PDB IDs match this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 11 hits for monomerid = 50330860   

TargetMultidrug and toxin extrusion protein 1(Human)
University of California

Curated by ChEMBL
LigandPNGBDBM50330860(Methylergometrine | CHEMBL1201356 | METHYLERGONOVI...)
Affinity DataIC50: 2.50E+5nMAssay Description:Inhibition of human MATE1-mediated ASP+ uptake expressed in HEK293 cells after 1.5 mins by fluorescence assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/24/2013
Entry Details Article
PubMed
LigandPNGBDBM50330860(Methylergometrine | CHEMBL1201356 | METHYLERGONOVI...)
Affinity DataKi:  0.490nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/25/2012
Entry Details Article
PubMed
LigandPNGBDBM50330860(Methylergometrine | CHEMBL1201356 | METHYLERGONOVI...)
Affinity DataKi:  0.800nMAssay Description:Displacement of [3H]LSD from human cloned 5HT2B receptor expressed in CHO cells by liquid scintillation countingMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/14/2011
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 7(Guinea pig)
Syntex Discovery Research

Curated by PDSP Ki Database
LigandPNGBDBM50330860(Methylergometrine | CHEMBL1201356 | METHYLERGONOVI...)
Affinity DataKi:  11.0nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/23/2011
Entry Details Article
PubMed
LigandPNGBDBM50330860(Methylergometrine | CHEMBL1201356 | METHYLERGONOVI...)
Affinity DataKi:  12.4nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/25/2012
Entry Details Article
PubMed
LigandPNGBDBM50330860(Methylergometrine | CHEMBL1201356 | METHYLERGONOVI...)
Affinity DataKi:  12.6nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/25/2012
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1F(Human)
University of Alberta

Curated by PDSP Ki Database
LigandPNGBDBM50330860(Methylergometrine | CHEMBL1201356 | METHYLERGONOVI...)
Affinity DataKi:  30.9nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/30/2011
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1F(Human)
University of Alberta

Curated by PDSP Ki Database
LigandPNGBDBM50330860(Methylergometrine | CHEMBL1201356 | METHYLERGONOVI...)
Affinity DataKi:  31nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/6/2012
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 7(Guinea pig)
Syntex Discovery Research

Curated by PDSP Ki Database
LigandPNGBDBM50330860(Methylergometrine | CHEMBL1201356 | METHYLERGONOVI...)
Affinity DataKi:  52.5nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/23/2011
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1E(Human)
Synaptic Pharmaceutical

Curated by PDSP Ki Database
LigandPNGBDBM50330860(Methylergometrine | CHEMBL1201356 | METHYLERGONOVI...)
Affinity DataKi:  89nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2011
Entry Details
PubMed
Target5-hydroxytryptamine receptor 1E(Human)
Synaptic Pharmaceutical

Curated by PDSP Ki Database
LigandPNGBDBM50330860(Methylergometrine | CHEMBL1201356 | METHYLERGONOVI...)
Affinity DataKi:  89.1nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/30/2011
Entry Details Article
PubMed