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BDBM50505380 CHEMBL4541939

SMILES: [H][C@@]12CC(CCCCCC)=C(c3ccccc3)[C@@]1(CC[C@@H]2NC(N)=O)C(=C)c1ccccc1

InChI Key: InChIKey=XPASWESTQXPXCV-ZEZDXWPOSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50505380   
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
Liver Receptor Homolog 1


(Homo sapiens (Human))		BDBM50505380
PNG
(CHEMBL4541939)
Show SMILES [H][C@@]12CC(CCCCCC)=C(c3ccccc3)[C@@]1(CC[C@@H]2NC(N)=O)C(=C)c1ccccc1 |r,t:9|
Show InChI InChI=1S/C29H36N2O/c1-3-4-5-8-17-24-20-25-26(31-28(30)32)18-19-29(25,21(2)22-13-9-6-10-14-22)27(24)23-15-11-7-12-16-23/h6-7,9-16,25-26H,2-5,8,17-20H2,1H3,(H3,30,31,32)/t25-,26-,29-/m0/s1
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n/an/an/an/a 500n/an/an/an/a



Emory University School of Medicine

Curated by ChEMBL


Assay Description
Agonist activity at human full length LRH1 transfected in human HeLa cells incubated for 24 hrs by renilla luciferase reporter gene assay

J Med Chem 62: 11022-11034 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00753
More data for this
Ligand-Target Pair