BDBM50586476 CHEMBL5081713

SMILES CN(C)c1ccc2c(-c3ccc(cc3C([O-])=O)C(=O)NCCOCCOCCOCCNC(=O)C3CCN(Cc4ccc(OCCCN5CCCCC5)cc4)CC3)c3ccc(cc3oc2c1)=[N+](C)C

InChI Key InChIKey=HCGJLZJKRXHJPL-UHFFFAOYSA-N

Data  5 KI  1 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50586476   

TargetHistamine H3 receptor(Human)
University of Regensburg

Curated by ChEMBL
LigandPNGBDBM50586476(CHEMBL5081713)
Affinity DataKd:  0.676nMAssay Description:Binding affinity to human H3R expressed in HEK293 cells by flow cytometric analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/7/2023
Entry Details Article
PubMed
TargetHistamine H3 receptor(Human)
University of Regensburg

Curated by ChEMBL
LigandPNGBDBM50586476(CHEMBL5081713)
Affinity DataKi:  0.158nMAssay Description:Binding affinity in Nluc-hH3R assessed in HEK293 cells by NanoBRET binding assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/7/2023
Entry Details Article
PubMed
TargetHistamine H3 receptor(Human)
University of Regensburg

Curated by ChEMBL
LigandPNGBDBM50586476(CHEMBL5081713)
Affinity DataKi:  0.302nMAssay Description:Displacement of [3H]UR-P1294 from human H3R receptor expressed in HEK293 cells by radioligand competition binding assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/7/2023
Entry Details Article
PubMed
TargetHistamine H1 receptor(Human)
University of Regensburg

Curated by ChEMBL
LigandPNGBDBM50586476(CHEMBL5081713)
Affinity DataKi: <1.00E+5nMAssay Description:Displacement of [3H]mepyramine from human H1R receptor expressed in HEK293 cells by radioligand competition binding assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/7/2023
Entry Details Article
PubMed
TargetHistamine H2 receptor(Human)
University of Regensburg

Curated by ChEMBL
LigandPNGBDBM50586476(CHEMBL5081713)
Affinity DataKi: <1.00E+5nMAssay Description:Displacement of [3H]UR-DE25 from human H2R receptor expressed in HEK293 cells by radioligand competition binding assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/7/2023
Entry Details Article
PubMed
TargetHistamine H4 receptor(Human)
University of Regensburg

Curated by ChEMBL
LigandPNGBDBM50586476(CHEMBL5081713)
Affinity DataKi: <1.00E+5nMAssay Description:Displacement of [3H]histamine from human H4R receptor expressed in HEK293 cells by radioligand competition binding assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/7/2023
Entry Details Article
PubMed