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BDBM50496703 CHEMBL1589735

SMILES: COc1ccc(cc1COc1ccc(NC(C)=O)cc1)C1Nc2ccccc2C(=O)N1CCc1ccccc1

InChI Key: InChIKey=FCMXLTXEOHXJLB-UHFFFAOYSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50496703   
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
Cytochrome P450 2C11


(Rattus norvegicus)		BDBM50496703
PNG
(CHEMBL1589735)
Show SMILES COc1ccc(cc1COc1ccc(NC(C)=O)cc1)C1Nc2ccccc2C(=O)N1CCc1ccccc1
Show InChI InChI=1S/C32H31N3O4/c1-22(36)33-26-13-15-27(16-14-26)39-21-25-20-24(12-17-30(25)38-2)31-34-29-11-7-6-10-28(29)32(37)35(31)19-18-23-8-4-3-5-9-23/h3-17,20,31,34H,18-19,21H2,1-2H3,(H,33,36)
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PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 430n/an/an/an/a



NIH Chemical Genomics Center

Curated by ChEMBL


Assay Description
Agonist activity at TSHR (unknown origin) transiently transfected HEK-EM293 cells assessed as cAMP level after 1 hr by ELISA

Medchemcomm 2: 1016-1020 (2011)


Article DOI: 10.1039/c1md00145k
BindingDB Entry DOI: 10.7270/Q2668H51
More data for this
Ligand-Target Pair