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Compile Data Set for Download or QSAR

Found 2 hits with Last Name = 'faedda' and Initial = 'r'   
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
Smoothened homolog


(Mus musculus)
BDBM50233217
PNG
(CHEMBL4090942)
Show SMILES COc1cccc(c1)C(=O)c1c([nH]c2ccccc2c1=O)-c1ccccc1
Show InChI InChI=1S/C23H17NO3/c1-27-17-11-7-10-16(14-17)22(25)20-21(15-8-3-2-4-9-15)24-19-13-6-5-12-18(19)23(20)26/h2-14H,1H3,(H,24,26)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 1.38E+4n/an/an/an/an/an/a



Sapienza University

Curated by ChEMBL


Assay Description
Inhibition of Bodipy-cyclopamine binding to mouse FLAG-tagged Smo expressed in HEK293 cells after 3 hrs by Hoechst staining based fluorescence assay


J Med Chem 60: 1469-1477 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01135
BindingDB Entry DOI: 10.7270/Q25X2C51
More data for this
Ligand-Target Pair
Smoothened homolog


(Mus musculus)
BDBM50233218
PNG
(CHEMBL4063037)
Show SMILES Brc1ccc2[nH]c(-c3ccccc3)c(C(=O)c3ccccc3)c(=O)c2c1
Show InChI InChI=1S/C22H14BrNO2/c23-16-11-12-18-17(13-16)22(26)19(21(25)15-9-5-2-6-10-15)20(24-18)14-7-3-1-4-8-14/h1-13H,(H,24,26)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 2.40E+4n/an/an/an/an/an/a



Sapienza University

Curated by ChEMBL


Assay Description
Inhibition of Bodipy-cyclopamine binding to mouse FLAG-tagged Smo expressed in HEK293 cells after 3 hrs by Hoechst staining based fluorescence assay


J Med Chem 60: 1469-1477 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01135
BindingDB Entry DOI: 10.7270/Q25X2C51
More data for this
Ligand-Target Pair