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SMILES: OC(=O)c1cc(O)cc2c(Br)cn(-c3ccc(O)cc3)c(=O)c12

InChI Key: InChIKey=MEUSXTGMSNLMBW-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 317461   
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
Estrogen receptor beta


(Homo sapiens (Human))
BDBM317461
PNG
(4-bromo-6-hydroxy-2-(4-hydroxyphenyl)-1-oxo-1,2- d...)
Show SMILES OC(=O)c1cc(O)cc2c(Br)cn(-c3ccc(O)cc3)c(=O)c12
Show InChI InChI=1S/C16H10BrNO5/c17-13-7-18(8-1-3-9(19)4-2-8)15(21)14-11(13)5-10(20)6-12(14)16(22)23/h1-7,19-20H,(H,22,23)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
130n/an/an/an/an/an/an/an/a



GTX, Inc.

US Patent


Assay Description
Recombinant ER-α or ER-β ligand binding domain (LBD) was combined with [3H]E2 (PerkinElmer, Waltham, Mass.) in buffer A (10 mM Tris, pH 7.4...


US Patent US9623021 (2017)


BindingDB Entry DOI: 10.7270/Q20C4XV9
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM317461
PNG
(4-bromo-6-hydroxy-2-(4-hydroxyphenyl)-1-oxo-1,2- d...)
Show SMILES OC(=O)c1cc(O)cc2c(Br)cn(-c3ccc(O)cc3)c(=O)c12
Show InChI InChI=1S/C16H10BrNO5/c17-13-7-18(8-1-3-9(19)4-2-8)15(21)14-11(13)5-10(20)6-12(14)16(22)23/h1-7,19-20H,(H,22,23)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
1.78E+3n/an/an/an/an/an/an/an/a



GTX, Inc.

US Patent


Assay Description
Recombinant ER-α or ER-β ligand binding domain (LBD) was combined with [3H]E2 (PerkinElmer, Waltham, Mass.) in buffer A (10 mM Tris, pH 7.4...


US Patent US9623021 (2017)


BindingDB Entry DOI: 10.7270/Q20C4XV9
More data for this
Ligand-Target Pair