BDBM50545196 CHEMBL4633772

SMILES COc1cc2CCN(C)C3Cc4ccc(NC(C)=O)cc4-c(c1OCC#C)c23

InChI Key InChIKey=SBQXZROAPGSYPJ-UHFFFAOYSA-N

Data  3 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50545196   

TargetD(1A) dopamine receptor(Human)
City University of New York

Curated by ChEMBL
LigandPNGBDBM50545196(CHEMBL4633772)
Affinity DataKi:  58nMAssay Description:Binding affinity to D1 receptor (unknown origin) assessed as inhibition constantMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
TargetD(1A) dopamine receptor(Human)
City University of New York

Curated by ChEMBL
LigandPNGBDBM50545196(CHEMBL4633772)
Affinity DataKi:  58nMAssay Description:Binding affinity to human D1 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/14/2021
Entry Details Article
PubMed
TargetD(2) dopamine receptor(Human)
City University of New York

Curated by ChEMBL
LigandPNGBDBM50545196(CHEMBL4633772)
Affinity DataKi:  854nMAssay Description:Binding affinity to D2 receptor (unknown origin) assessed as inhibition constantMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
TargetD(2) dopamine receptor(Human)
City University of New York

Curated by ChEMBL
LigandPNGBDBM50545196(CHEMBL4633772)
Affinity DataKi:  854nMAssay Description:Binding affinity to human D2 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/14/2021
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2A(Human)
City University of New York

Curated by ChEMBL
LigandPNGBDBM50545196(CHEMBL4633772)
Affinity DataKi:  1.27E+3nMAssay Description:Binding affinity to human 5HT2A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/14/2021
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2A(Human)
City University of New York

Curated by ChEMBL
LigandPNGBDBM50545196(CHEMBL4633772)
Affinity DataKi:  1.27E+3nMAssay Description:Binding affinity to 5HT2A (unknown origin) assessed as inhibition constantMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed