BindingDB logo
myBDB logout

BDBM50412221 CHEMBL516608

SMILES: CCNCc1cccc(c1)C(=O)Nc1cc(C)n(Cc2cc(Cl)ccc2OCC(C)C)n1

InChI Key: InChIKey=OUHRZGSWJJRSHY-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50412221   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Prostaglandin E2 receptor EP1 subtype


(Homo sapiens (Human))
BDBM50412221
PNG
(CHEMBL516608)
Show SMILES CCNCc1cccc(c1)C(=O)Nc1cc(C)n(Cc2cc(Cl)ccc2OCC(C)C)n1
Show InChI InChI=1S/C25H31ClN4O2/c1-5-27-14-19-7-6-8-20(12-19)25(31)28-24-11-18(4)30(29-24)15-21-13-22(26)9-10-23(21)32-16-17(2)3/h6-13,17,27H,5,14-16H2,1-4H3,(H,28,29,31)
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 501n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [H3PGE2 from human EP1 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 18: 4027-32 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.118
BindingDB Entry DOI: 10.7270/Q2NC62F7
More data for this
Ligand-Target Pair