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SMILES: Oc1ccc([C@H]2NC=N[C@H]2c2ccc(O)cc2I)c(I)c1

InChI Key: InChIKey=PSYOLUOXRAVXSM-GASCZTMLSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50409553   
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


(Homo sapiens (Human))		BDBM50409553
PNG
(CHEMBL112355)
Show SMILES Oc1ccc([C@H]2NC=N[C@H]2c2ccc(O)cc2I)c(I)c1 |c:7|
Show InChI InChI=1S/C15H12I2N2O2/c16-12-5-8(20)1-3-10(12)14-15(19-7-18-14)11-4-2-9(21)6-13(11)17/h1-7,14-15,20-21H,(H,18,19)/t14-,15+
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/an/an/a 1.80E+3n/an/an/an/a



Free University of Berlin

Curated by ChEMBL


Assay Description
Agonist activity in transcriptional activation assay in MCF-7-2a cells compared to estradiol E2

J Med Chem 45: 3356-65 (2002)


BindingDB Entry DOI: 10.7270/Q29W0GP4
More data for this
Ligand-Target Pair