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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50346810   
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
Protein disulfide-isomerase


(Homo sapiens (Human))
BDBM50346810
PNG
(CHEMBL268559)
Show SMILES COc1ccc(\C=C\C(=O)c2ccc(O)cc2)cc1
Show InChI InChI=1S/C16H14O3/c1-19-15-9-2-12(3-10-15)4-11-16(18)13-5-7-14(17)8-6-13/h2-11,17H,1H3/b11-4+
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MMDB

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CHEMBL
MCE
PC cid
PC sid
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Similars

Article
PubMed
n/an/a 1.74E+3n/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Inhibition of recombinant human N-terminal His-tagged PDI expressed in Escherichia coli BL21 (DE3) pLysS assessed as reduction in enzyme-mediated bov...


J Med Chem 62: 3447-3474 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01951
BindingDB Entry DOI: 10.7270/Q29W0JWN
More data for this
Ligand-Target Pair
Calmodulin-1


(Human)
BDBM50346810
PNG
(CHEMBL268559)
Show SMILES COc1ccc(\C=C\C(=O)c2ccc(O)cc2)cc1
Show InChI InChI=1S/C16H14O3/c1-19-15-9-2-12(3-10-15)4-11-16(18)13-5-7-14(17)8-6-13/h2-11,17H,1H3/b11-4+
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 2.25E+4n/an/an/an/an/an/a



Universidad Nacional Aut£noma de M£xico

Curated by ChEMBL


Assay Description
Inhibition of Calmodulin-dependent PDE1 activity assessed as inorganic phosphate release after 30 min


Eur J Med Chem 46: 2699-708 (2011)


Article DOI: 10.1016/j.ejmech.2011.03.057
BindingDB Entry DOI: 10.7270/Q2MW2HGD
More data for this
Ligand-Target Pair