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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50498570   
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


(MOUSE)
BDBM50498570
PNG
(CHEMBL3608938)
Show SMILES CCCCC(NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F |r|
Show InChI InChI=1S/C49H53F6N7O8/c1-3-4-13-39(45(67)62-41(23-32-25-57-38-14-9-8-12-36(32)38)47(69)70-27-31-19-33(48(50,51)52)24-34(20-31)49(53,54)55)61-46(68)40(22-29-10-6-5-7-11-29)60-42(64)26-58-43(65)28(2)59-44(66)37(56)21-30-15-17-35(63)18-16-30/h5-12,14-20,24-25,28,37,39-41,57,63H,3-4,13,21-23,26-27,56H2,1-2H3,(H,58,65)(H,59,66)(H,60,64)(H,61,68)(H,62,67)/t28-,37+,39?,40+,41+/m1/s1
PDB

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UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 6n/an/an/an/an/an/a



University of Arizona

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens assessed as inhibition of electrically-stimulated muscle contraction


Bioorg Med Chem Lett 25: 3716-20 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.030
BindingDB Entry DOI: 10.7270/Q2R78J7N
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50498570
PNG
(CHEMBL3608938)
Show SMILES CCCCC(NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F |r|
Show InChI InChI=1S/C49H53F6N7O8/c1-3-4-13-39(45(67)62-41(23-32-25-57-38-14-9-8-12-36(32)38)47(69)70-27-31-19-33(48(50,51)52)24-34(20-31)49(53,54)55)61-46(68)40(22-29-10-6-5-7-11-29)60-42(64)26-58-43(65)28(2)59-44(66)37(56)21-30-15-17-35(63)18-16-30/h5-12,14-20,24-25,28,37,39-41,57,63H,3-4,13,21-23,26-27,56H2,1-2H3,(H,58,65)(H,59,66)(H,60,64)(H,61,68)(H,62,67)/t28-,37+,39?,40+,41+/m1/s1
PDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.10E+3n/an/an/an/an/an/a



University of Arizona

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in guinea pig ileum assessed as inhibition of electrically-stimulated muscle contraction


Bioorg Med Chem Lett 25: 3716-20 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.030
BindingDB Entry DOI: 10.7270/Q2R78J7N
More data for this
Ligand-Target Pair