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SMILES: C[C@@H]([C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CCCC[C@H]1NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(N)=O)c1ccccc1

InChI Key: InChIKey=QUHPFWVYCKCMPQ-HHOYWZPISA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50339241   
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
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50339241
PNG
((1S,2R)-N-((S)-1-((2R,3R)-1-amino-1-oxo-3-phenylbu...)
Show SMILES C[C@@H]([C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CCCC[C@H]1NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(N)=O)c1ccccc1 |r|
Show InChI InChI=1S/C35H43N5O5/c1-22(25-12-6-3-7-13-25)31(32(37)42)40-35(45)30(21-23-10-4-2-5-11-23)39-33(43)27-14-8-9-15-29(27)38-34(44)28(36)20-24-16-18-26(41)19-17-24/h2-7,10-13,16-19,22,27-31,41H,8-9,14-15,20-21,36H2,1H3,(H2,37,42)(H,38,44)(H,39,43)(H,40,45)/t22-,27+,28+,29-,30+,31-/m1/s1
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PC cid
PC sid
UniChem

Similars

Article
PubMed
33.9n/an/an/an/an/an/an/an/a



Hungarian Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain membrane homogenate by liquid scintillation counting


J Med Chem 54: 1462-72 (2011)


Article DOI: 10.1021/jm101515v
BindingDB Entry DOI: 10.7270/Q26T0MX9
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50339241
PNG
((1S,2R)-N-((S)-1-((2R,3R)-1-amino-1-oxo-3-phenylbu...)
Show SMILES C[C@@H]([C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CCCC[C@H]1NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(N)=O)c1ccccc1 |r|
Show InChI InChI=1S/C35H43N5O5/c1-22(25-12-6-3-7-13-25)31(32(37)42)40-35(45)30(21-23-10-4-2-5-11-23)39-33(43)27-14-8-9-15-29(27)38-34(44)28(36)20-24-16-18-26(41)19-17-24/h2-7,10-13,16-19,22,27-31,41H,8-9,14-15,20-21,36H2,1H3,(H2,37,42)(H,38,44)(H,39,43)(H,40,45)/t22-,27+,28+,29-,30+,31-/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.27E+3n/an/an/an/an/an/an/an/a



Hungarian Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H][Ile5,6]deltorphin2 from delta opioid receptor in rat brain membrane homogenate by liquid scintillation counting


J Med Chem 54: 1462-72 (2011)


Article DOI: 10.1021/jm101515v
BindingDB Entry DOI: 10.7270/Q26T0MX9
More data for this
Ligand-Target Pair