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SMILES: Nc1nc(c(s1)C(=O)c1ccccc1Cl)-c1ccc(Br)c(c1)C(F)(F)F

InChI Key: InChIKey=GZAYAIMGPUUFGT-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50460735   
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
Nuclear receptor ROR-beta


(Homo sapiens (Human))		BDBM50460735
PNG
(CHEMBL4226334)
Show SMILES Nc1nc(c(s1)C(=O)c1ccccc1Cl)-c1ccc(Br)c(c1)C(F)(F)F
Show InChI InChI=1S/C17H9BrClF3N2OS/c18-11-6-5-8(7-10(11)17(20,21)22)13-15(26-16(23)24-13)14(25)9-3-1-2-4-12(9)19/h1-7H,(H2,23,24)
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MMDB

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n/an/a 290n/an/an/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Displacement of [3H]-T0901317 from recombinant human His-SUMO-tagged RORbeta LBD (71 to 459 residues) expressed in Escherichia coli BL21(DE3) at afte...

Bioorg Med Chem Lett 28: 1178-1181 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.001
BindingDB Entry DOI: 10.7270/Q26T0Q9G
More data for this
Ligand-Target Pair