BindingDB logo
myBDB logout

null

SMILES: COc1ccc(cc1OC)C(=O)N1CCN(C(CN2CCCC2)C1)C(=O)CN(C)c1ccc(Cl)c(Cl)c1

InChI Key: InChIKey=UMXZNJPMGVPDDD-UHFFFAOYSA-N

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 = 50272255   
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
Kappa-type opioid receptor


(Homo sapiens (Human))		BDBM50272255
PNG
(2-((3,4-dichlorophenyl)(methyl)amino)-1-(4-(3,4-di...)
Show SMILES COc1ccc(cc1OC)C(=O)N1CCN(C(CN2CCCC2)C1)C(=O)CN(C)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C27H34Cl2N4O4/c1-30(20-7-8-22(28)23(29)15-20)18-26(34)33-13-12-32(17-21(33)16-31-10-4-5-11-31)27(35)19-6-9-24(36-2)25(14-19)37-3/h6-9,14-15,21H,4-5,10-13,16-18H2,1-3H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/an/an/a>1.00E+4n/an/an/an/a



GlaxoSmithKline Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human kappa opioid receptor expressed in CHO-K1 cells by [35S]GTPgamma binding assay

Bioorg Med Chem Lett 18: 4470-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.067
BindingDB Entry DOI: 10.7270/Q2TH8MHF
More data for this
Ligand-Target Pair