BDBM50086005 CHEMBL274842::N-[2-(10-Methoxy-5,6-dihydro-indolo[2,1-a]isoquinolin-12-yl)-ethyl]-acetamide

SMILES COc1ccc2n3CCc4ccccc4-c3c(CCNC(C)=O)c2c1

InChI Key InChIKey=YJUIMSHUKZPSNN-UHFFFAOYSA-N

Data  2 KI

  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 4 hits for monomerid = 50086005   

TargetMelatonin receptor type 1B(Human)
The First Affiliated Hospital of China Medical University

Curated by ChEMBL
LigandPNGBDBM50086005(N-[2-(10-Methoxy-5,6-dihydro-indolo[2,1-a]isoquino...)
Affinity DataKi:  0.0600nMAssay Description:Binding affinity to human MT2 receptor assessed as inhibition constantMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
TargetMelatonin receptor type 1B(Human)
The First Affiliated Hospital of China Medical University

Curated by ChEMBL
LigandPNGBDBM50086005(N-[2-(10-Methoxy-5,6-dihydro-indolo[2,1-a]isoquino...)
Affinity DataKi:  0.510nMAssay Description:Binding affinity towards recombinant human melatonin receptor type 1B expressed in NIH 3T3 cells using 2-[121I]iodomelatonin radioligand binding assa...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/25/2012
Entry Details Article
PubMed
TargetMelatonin receptor type 1A(Human)
The First Affiliated Hospital of China Medical University

Curated by ChEMBL
LigandPNGBDBM50086005(N-[2-(10-Methoxy-5,6-dihydro-indolo[2,1-a]isoquino...)
Affinity DataKi:  1.80nMAssay Description:Binding affinity to human MT1 receptor assessed as inhibition constantMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
TargetMelatonin receptor type 1A(Human)
The First Affiliated Hospital of China Medical University

Curated by ChEMBL
LigandPNGBDBM50086005(N-[2-(10-Methoxy-5,6-dihydro-indolo[2,1-a]isoquino...)
Affinity DataKi:  7.24nMAssay Description:Binding affinity towards recombinant human melatonin receptor type 1A expressed in NIH 3T3 cells using 2-[121I]iodomelatonin radioligand binding assa...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/25/2012
Entry Details Article
PubMed