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SMILES: C[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(N)=N)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(N)=O

InChI Key: InChIKey=QGMWRQMGINJKHY-FDHJMSBKSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50453765   
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))
BDBM50453765
PNG
(CHEMBL4215224)
Show SMILES C[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(N)=N)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(N)=O |r|
Show InChI InChI=1S/C35H40ClN9O6/c1-19(42-33(50)28(45-35(38)39)15-21-8-12-24(46)13-9-21)32(49)41-18-30(47)43-29(16-22-17-40-26-5-3-2-4-25(22)26)34(51)44-27(31(37)48)14-20-6-10-23(36)11-7-20/h2-13,17,19,27-29,40,46H,14-16,18H2,1H3,(H2,37,48)(H,41,49)(H,42,50)(H,43,47)(H,44,51)(H4,38,39,45)/t19-,27+,28+,29+/m1/s1
PDB

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UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
3.20n/an/an/an/an/an/an/an/a



The First Hospital of Lanzhou University

Curated by ChEMBL


Assay Description
Displacement of [3H]-DAMGO from mu opioid receptor in Wistar rat brain membranes preincubated for 1 hr measured after 1hr by scintillation counting m...


Bioorg Med Chem Lett 27: 1557-1560 (2017)


Article DOI: 10.1016/j.bmcl.2017.02.034
BindingDB Entry DOI: 10.7270/Q2DN47NT
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50453765
PNG
(CHEMBL4215224)
Show SMILES C[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(N)=N)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(N)=O |r|
Show InChI InChI=1S/C35H40ClN9O6/c1-19(42-33(50)28(45-35(38)39)15-21-8-12-24(46)13-9-21)32(49)41-18-30(47)43-29(16-22-17-40-26-5-3-2-4-25(22)26)34(51)44-27(31(37)48)14-20-6-10-23(36)11-7-20/h2-13,17,19,27-29,40,46H,14-16,18H2,1H3,(H2,37,48)(H,41,49)(H,42,50)(H,43,47)(H,44,51)(H4,38,39,45)/t19-,27+,28+,29+/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
2.03E+3n/an/an/an/an/an/an/an/a



The First Hospital of Lanzhou University

Curated by ChEMBL


Assay Description
Displacement of [3H]-DPDPE from delta opioid receptor in Wistar rat brain membranes preincubated for 3 hrs measured after 1 hr by scintillation count...


Bioorg Med Chem Lett 27: 1557-1560 (2017)


Article DOI: 10.1016/j.bmcl.2017.02.034
BindingDB Entry DOI: 10.7270/Q2DN47NT
More data for this
Ligand-Target Pair