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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 = 'BDBM50027104'   
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))
BDBM50027104
PNG
(CHEMBL2113372)
Show SMILES [H][C@@]12Oc3c4c(CC5N(C)CC[C@@]14[C@]5(Cc1c2[nH]c2ccccc12)NC(=O)CCCCCC)ccc3O |TLB:9:8:13:4.5.6|
Show InChI InChI=1S/C30H35N3O3/c1-3-4-5-6-11-24(35)32-30-17-20-19-9-7-8-10-21(19)31-26(20)28-29(30)14-15-33(2)23(30)16-18-12-13-22(34)27(36-28)25(18)29/h7-10,12-13,23,28,31,34H,3-6,11,14-17H2,1-2H3,(H,32,35)/t23?,28-,29-,30+/m0/s1
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Article
PubMed
10n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]C1-DPDPE from human recombinant Opioid receptor delta 1 on CHO cell membranes.


J Med Chem 46: 1563-6 (2003)


Article DOI: 10.1021/jm021073r
BindingDB Entry DOI: 10.7270/Q27945F9
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50027104
PNG
(CHEMBL2113372)
Show SMILES [H][C@@]12Oc3c4c(CC5N(C)CC[C@@]14[C@]5(Cc1c2[nH]c2ccccc12)NC(=O)CCCCCC)ccc3O |TLB:9:8:13:4.5.6|
Show InChI InChI=1S/C30H35N3O3/c1-3-4-5-6-11-24(35)32-30-17-20-19-9-7-8-10-21(19)31-26(20)28-29(30)14-15-33(2)23(30)16-18-12-13-22(34)27(36-28)25(18)29/h7-10,12-13,23,28,31,34H,3-6,11,14-17H2,1-2H3,(H,32,35)/t23?,28-,29-,30+/m0/s1
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 19n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Stimulation of [35S]GTP-gamma-S, binding at human recombinant Opioid receptor delta 1 transfected into CHO cells.


J Med Chem 46: 1563-6 (2003)


Article DOI: 10.1021/jm021073r
BindingDB Entry DOI: 10.7270/Q27945F9
More data for this
Ligand-Target Pair