BDBM50191594 CHEMBL375002::Demotensin 4

SMILES [#6]-[#6](-[#6])-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6]-[#6](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6](-[#6]-[#7]-[#6]-[#6]-[#7])-[#6]-[#7]-[#6]-[#6]-[#7])C([#6])([#6])[#6])-[#6](-[#8])=O

InChI Key InChIKey=LMLFUZNFPWAFHU-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 50191594   

TargetNeurotensin receptor type 1(Human)
National Center For Scientific Research Demokritos

Curated by ChEMBL
LigandPNGBDBM50191594(Demotensin 4 | CHEMBL375002)
Affinity DataIC50: 0.510nMAssay Description:Displacement of [125I]Tyr3-NT from human NTS1R expressed in WiDr cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/7/2012
Entry Details Article
PubMed
TargetNeurotensin receptor type 1(Human)
National Center For Scientific Research Demokritos

Curated by ChEMBL
LigandPNGBDBM50191594(Demotensin 4 | CHEMBL375002)
Affinity DataIC50: 0.850nMAssay Description:Displacement of [125I]Tyr3-NT from human NTS1R expressed in HT29 cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/7/2012
Entry Details Article
PubMed
TargetNeurotensin receptor type 1(Human)
National Center For Scientific Research Demokritos

Curated by ChEMBL
LigandPNGBDBM50191594(Demotensin 4 | CHEMBL375002)
Affinity DataIC50: 2.90nMAssay Description:Displacement of [125I]Tyr3-NT from NTS1R in human exocrine ductal pancreatic carcinomaMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/7/2012
Entry Details Article
PubMed