BDBM50043287 CHEMBL33415::Melatonin,2-Bromo::N-[2-(2-Bromo-5-methoxy-1H-indol-3-yl)-ethyl]-acetamide::N-[2-(2-Bromo-5-methoxy-1H-indol-3-yl)-ethyl]-acetamide(2-Bromomelatonin)

SMILES COc1ccc2[nH]c(Br)c(CCNC(C)=O)c2c1

InChI Key InChIKey=FNHLXIXCQDGUCQ-UHFFFAOYSA-N

Data  7 KI  2 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 9 hits for monomerid = 50043287   

TargetMelatonin receptor type 1A(Human)
Universit&Aagrove

Curated by PDSP Ki Database
LigandPNGBDBM50043287(CHEMBL33415 | Melatonin,2-Bromo | N-[2-(2-Bromo-5-...)
Affinity DataKi:  0.0200nMMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetMelatonin receptor type 1A/1B(Human)
University of Urbino

Curated by ChEMBL
LigandPNGBDBM50043287(CHEMBL33415 | Melatonin,2-Bromo | N-[2-(2-Bromo-5-...)
Affinity DataKi:  0.0360nMAssay Description:Binding affinity against melatonin receptor in the quail optica tecta using 2-[125] iodomelatonin (100 pM) as labelled ligandMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetMelatonin receptor type 1A/1B(Human)
University of Urbino

Curated by ChEMBL
LigandPNGBDBM50043287(CHEMBL33415 | Melatonin,2-Bromo | N-[2-(2-Bromo-5-...)
Affinity DataKi:  0.0360nMAssay Description:Binding affinity against melatonin receptor in the quail optica tecta using 2-[125] iodomelatonin as labelled ligandMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetMelatonin receptor type 1A/1B(Human)
University of Urbino

Curated by ChEMBL
LigandPNGBDBM50043287(CHEMBL33415 | Melatonin,2-Bromo | N-[2-(2-Bromo-5-...)
Affinity DataKi:  0.0580nMAssay Description:Inhibition of 2-[125I]iodomelatonin binding to melatonin receptor in quail brain as 1/KaMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetMelatonin receptor type 1B(Human)
Universit&Agrove

Curated by PDSP Ki Database
LigandPNGBDBM50043287(CHEMBL33415 | Melatonin,2-Bromo | N-[2-(2-Bromo-5-...)
Affinity DataKi:  0.110nMMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetMelatonin receptor type 1A(Human)
Universit&Aagrove

Curated by PDSP Ki Database
LigandPNGBDBM50043287(CHEMBL33415 | Melatonin,2-Bromo | N-[2-(2-Bromo-5-...)
Affinity DataKi:  0.120nMMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetMelatonin receptor type 1B(Human)
Universit&Agrove

Curated by PDSP Ki Database
LigandPNGBDBM50043287(CHEMBL33415 | Melatonin,2-Bromo | N-[2-(2-Bromo-5-...)
Affinity DataKi:  0.160nMMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetMelatonin receptor type 1A/1B(Human)
University of Urbino

Curated by ChEMBL
LigandPNGBDBM50043287(CHEMBL33415 | Melatonin,2-Bromo | N-[2-(2-Bromo-5-...)
Affinity DataIC50:  0.130nMAssay Description:Inhibitory activity against melatonin receptor in the quail optica tecta using 2-[125] iodomelatonin as labelled ligandMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetMelatonin receptor type 1A/1B(Human)
University of Urbino

Curated by ChEMBL
LigandPNGBDBM50043287(CHEMBL33415 | Melatonin,2-Bromo | N-[2-(2-Bromo-5-...)
Affinity DataIC50:  0.130nMAssay Description:Inhibitory activity against melatonin receptor in the quail optica tecta using 2-[125] iodomelatonin as radiolabeled ligandMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed