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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Delta-type opioid receptor' and Ligand = 'BDBM50297325'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50297325
PNG
(CHEMBL556439 | N,N-Diethyl-4-(spiro[chromene-2,3'-...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C1=CC2(CCNC2)Oc2ccccc12 |t:14|
Show InChI InChI=1S/C23H26N2O2/c1-3-25(4-2)22(26)18-11-9-17(10-12-18)20-15-23(13-14-24-16-23)27-21-8-6-5-7-19(20)21/h5-12,15,24H,3-4,13-14,16H2,1-2H3
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PC cid
PC sid
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Article
PubMed
18n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human delta opioid receptor expressed in CHO cells


J Med Chem 52: 5685-702 (2009)


Article DOI: 10.1021/jm900773n
BindingDB Entry DOI: 10.7270/Q2VD6ZH3
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50297325
PNG
(CHEMBL556439 | N,N-Diethyl-4-(spiro[chromene-2,3'-...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C1=CC2(CCNC2)Oc2ccccc12 |t:14|
Show InChI InChI=1S/C23H26N2O2/c1-3-25(4-2)22(26)18-11-9-17(10-12-18)20-15-23(13-14-24-16-23)27-21-8-6-5-7-19(20)21/h5-12,15,24H,3-4,13-14,16H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents


Similars

Article
PubMed
n/an/an/an/a 28n/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTPgammaS binding


J Med Chem 52: 5685-702 (2009)


Article DOI: 10.1021/jm900773n
BindingDB Entry DOI: 10.7270/Q2VD6ZH3
More data for this
Ligand-Target Pair