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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 23448   
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
Estrogen receptor


(Homo sapiens (Human))
BDBM23448
PNG
(BUTYLPARABEN | Butyl paraben | Nipabutyl | butyl 4...)
Show SMILES CCCCOC(=O)c1ccc(O)cc1
Show InChI InChI=1S/C11H14O3/c1-2-3-8-14-11(13)9-4-6-10(12)7-5-9/h4-7,12H,2-3,8H2,1H3
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UniProtKB/SwissProt

antibodypedia
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MCE
PC cid
PC sid
PDB
UniChem

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Similars

PDB
Article
PubMed
n/an/a 1.42E+3n/an/an/an/an/an/a



Longwood University

Curated by ChEMBL


Assay Description
Displacement of Fluor.ES2 Green from human ERalpha by TR-FRET competitive binding assay


ACS Med Chem Lett 9: 51-55 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00431
BindingDB Entry DOI: 10.7270/Q2TF00W6
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
2-5A-dependent ribonuclease


(Homo sapiens (Human))
BDBM23448
PNG
(BUTYLPARABEN | Butyl paraben | Nipabutyl | butyl 4...)
Show SMILES CCCCOC(=O)c1ccc(O)cc1
Show InChI InChI=1S/C11H14O3/c1-2-3-8-14-11(13)9-4-6-10(12)7-5-9/h4-7,12H,2-3,8H2,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

MCE
PC cid
PC sid
PDB
UniChem

Patents


Similars

Article
PubMed
n/an/a 2.40E+6n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full length H-RNAase L (1 to 741 residues) expressed in Escherichia coli BL21 (DE3) assessed as inhibition rate in presence...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01156
BindingDB Entry DOI: 10.7270/Q2KD22SX
More data for this
Ligand-Target Pair