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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Opioid receptor' and Ligand = 'BDBM50403821'   
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
Opioid receptor


(MOUSE)
BDBM50403821
PNG
(CHEMBL93891)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N1Cc2ccc(F)cc2CC1C(O)=O
Show InChI InChI=1S/C21H23FN2O4/c1-11-5-16(25)6-12(2)17(11)9-18(23)20(26)24-10-13-3-4-15(22)7-14(13)8-19(24)21(27)28/h3-7,18-19,25H,8-10,23H2,1-2H3,(H,27,28)/t18-,19?/m0/s1
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GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
0.320n/an/an/an/an/an/an/an/a



University of Naples

Curated by ChEMBL


Assay Description
Inhibitory concentration against Opioid receptor delta 1 in mouse vas deferens using competition binding assay


Bioorg Med Chem Lett 10: 2745-8 (2000)


Article DOI: 10.1016/s0960-894x(00)00569-2
BindingDB Entry DOI: 10.7270/Q25H7HF1
More data for this
Ligand-Target Pair
Opioid receptor


(MOUSE)
BDBM50403821
PNG
(CHEMBL93891)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N1Cc2ccc(F)cc2CC1C(O)=O
Show InChI InChI=1S/C21H23FN2O4/c1-11-5-16(25)6-12(2)17(11)9-18(23)20(26)24-10-13-3-4-15(22)7-14(13)8-19(24)21(27)28/h3-7,18-19,25H,8-10,23H2,1-2H3,(H,27,28)/t18-,19?/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
65n/an/an/an/an/an/an/an/a



University of Naples

Curated by ChEMBL


Assay Description
Inhibitory concentration against Opioid receptor delta 1 in mouse vas deferens using competition binding assay


Bioorg Med Chem Lett 10: 2745-8 (2000)


Article DOI: 10.1016/s0960-894x(00)00569-2
BindingDB Entry DOI: 10.7270/Q25H7HF1
More data for this
Ligand-Target Pair