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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 = 'BDBM50108346'   
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


(Rattus norvegicus (rat))
BDBM50108346
PNG
(CHEMBL295295 | Indole Derivative)
Show SMILES C[C@@H]1C2C3Cc4ccc(O)c5O[C@@H](c6[nH]c7ccccc7c16)C2(CCN3C)c45 |TLB:10:27:2:25.23.24|
Show InChI InChI=1S/C24H24N2O2/c1-12-18-14-5-3-4-6-15(14)25-21(18)23-24-9-10-26(2)16(19(12)24)11-13-7-8-17(27)22(28-23)20(13)24/h3-8,12,16,19,23,25,27H,9-11H2,1-2H3/t12-,16?,19?,23-,24?/m0/s1
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PC cid
PC sid
UniChem

Similars

PubMed
0.700n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Binding affinity for delta opioid receptor by displacing [3H]DADL was determined


Bioorg Med Chem Lett 12: 165-8 (2001)


BindingDB Entry DOI: 10.7270/Q2S181T9
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50108346
PNG
(CHEMBL295295 | Indole Derivative)
Show SMILES C[C@@H]1C2C3Cc4ccc(O)c5O[C@@H](c6[nH]c7ccccc7c16)C2(CCN3C)c45 |TLB:10:27:2:25.23.24|
Show InChI InChI=1S/C24H24N2O2/c1-12-18-14-5-3-4-6-15(14)25-21(18)23-24-9-10-26(2)16(19(12)24)11-13-7-8-17(27)22(28-23)20(13)24/h3-8,12,16,19,23,25,27H,9-11H2,1-2H3/t12-,16?,19?,23-,24?/m0/s1
PDB

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KEGG

UniProtKB/SwissProt

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

Similars

PubMed
49n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Binding affinity of the compound for gamma-S binding assay


Bioorg Med Chem Lett 12: 165-8 (2001)


BindingDB Entry DOI: 10.7270/Q2S181T9
More data for this
Ligand-Target Pair