BindingDB logo
myBDB logout

1 similar compounds to monomer 94503

Compile data set for download or QSAR
Wt: 404.5
BDBM50177898

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50177898   
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


(MOUSE)
BDBM50177898
PNG
(2-Fluoro-N-[4-methoxymethyl-1-(2-thiophen-2-yl-eth...)
Show SMILES COCC1(CCN(CCc2cccs2)CC1)N(C(=O)C(C)F)c1ccccc1
Show InChI InChI=1S/C22H29FN2O2S/c1-18(23)21(26)25(19-7-4-3-5-8-19)22(17-27-2)11-14-24(15-12-22)13-10-20-9-6-16-28-20/h3-9,16,18H,10-15,17H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
0.100n/an/an/an/an/an/an/an/a



Technische Universit£t M£nchen

Curated by ChEMBL


Assay Description
Binding constant for Opioid receptor mu 1 in mouse


Bioorg Med Chem Lett 15: 1773-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.049
BindingDB Entry DOI: 10.7270/Q28916M4
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50177898
PNG
(2-Fluoro-N-[4-methoxymethyl-1-(2-thiophen-2-yl-eth...)
Show SMILES COCC1(CCN(CCc2cccs2)CC1)N(C(=O)C(C)F)c1ccccc1
Show InChI InChI=1S/C22H29FN2O2S/c1-18(23)21(26)25(19-7-4-3-5-8-19)22(17-27-2)11-14-24(15-12-22)13-10-20-9-6-16-28-20/h3-9,16,18H,10-15,17H2,1-2H3
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
0.130n/an/an/an/an/an/an/an/a



Technische Universität München

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from recombinant human mu opioid receptor


J Med Chem 48: 7720-32 (2005)


Article DOI: 10.1021/jm0507274
BindingDB Entry DOI: 10.7270/Q2G44PVB
More data for this
Ligand-Target Pair