BDBM50398339 CHEMBL2178569

SMILES CC1(C)CN(CC\C=C2/c3cccnc3COc3ccc(cc23)C(O)=O)C[C@@H]([C@H]1O)c1ccc(Cl)cc1

InChI Key InChIKey=QKMUXXQVPOBBPT-UHFFFAOYSA-N

Data  3 KI  1 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 4 hits for monomerid = 50398339   

TargetC-C chemokine receptor type 5(Human)
National Heart and Lung Institute

Curated by ChEMBL
LigandPNGBDBM50398339(CHEMBL2178569)
Affinity DataKi:  1nMAssay Description:Binding affinity to CCR5More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/17/2013
Entry Details Article
PubMed
TargetMuscarinic acetylcholine receptor M2(Human)
National Heart and Lung Institute

Curated by ChEMBL
LigandPNGBDBM50398339(CHEMBL2178569)
Affinity DataKi:  1.30nMAssay Description:Binding affinity to muscarinic M2 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/17/2013
Entry Details Article
PubMed
TargetC-C chemokine receptor type 1(Human)
National Heart and Lung Institute

Curated by ChEMBL
LigandPNGBDBM50398339(CHEMBL2178569)
Affinity DataKi:  2.30nMAssay Description:Binding affinity to CCR1More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/17/2013
Entry Details Article
PubMed
TargetC-C chemokine receptor type 1(Human)
National Heart and Lung Institute

Curated by ChEMBL
LigandPNGBDBM50398339(CHEMBL2178569)
Affinity DataIC50: 3.40nMAssay Description:Antagonist activity at CCR1 assessed as inhibition of CCL3-induced chemotaxis by cell based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/17/2013
Entry Details Article
PubMed