BDBM50340328 CHEMBL1760955::N-(2-(6-methoxy-3-(2,2,2-trifluoroacetyl)-1H-pyrrolo[2,3-b]pyridin-1-yl)ethyl)acetamide

SMILES COc1ccc2c(cn(CCNC(C)=O)c2n1)C(=O)C(F)(F)F

InChI Key InChIKey=JDACSMSKZRUGMB-UHFFFAOYSA-N

Data  2 KI  2 EC50

  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 = 50340328   

TargetMelatonin receptor type 1B(Human)
Orleans University

Curated by ChEMBL
LigandPNGBDBM50340328(N-(2-(6-methoxy-3-(2,2,2-trifluoroacetyl)-1H-pyrro...)
Affinity DataEC50:  10nMAssay Description:Agonist activity at human MT2 receptor expressed in CHO cells by [35S]GTPgamma binding assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/2/2011
Entry Details Article
PubMed
TargetMelatonin receptor type 1A(Human)
Orleans University

Curated by ChEMBL
LigandPNGBDBM50340328(N-(2-(6-methoxy-3-(2,2,2-trifluoroacetyl)-1H-pyrro...)
Affinity DataEC50:  93nMAssay Description:Agonist activity at human MT1 receptor expressed in CHO cells by [35S]GTPgamma binding assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/2/2011
Entry Details Article
PubMed
TargetMelatonin receptor type 1B(Human)
Orleans University

Curated by ChEMBL
LigandPNGBDBM50340328(N-(2-(6-methoxy-3-(2,2,2-trifluoroacetyl)-1H-pyrro...)
Affinity DataKi:  30nMAssay Description:Displacement of 2-[125I]-iodomelatonin from human MT2 receptor expressed in HEK293 cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/2/2011
Entry Details Article
PubMed
TargetMelatonin receptor type 1A(Human)
Orleans University

Curated by ChEMBL
LigandPNGBDBM50340328(N-(2-(6-methoxy-3-(2,2,2-trifluoroacetyl)-1H-pyrro...)
Affinity DataKi:  91nMAssay Description:Displacement of 2-[125I]-iodomelatonin from human MT1 receptor expressed in HEK293 cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/2/2011
Entry Details Article
PubMed