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SMILES: Clc1cccc(c1)-c1ncsc1C(=O)c1ccccc1Cl

InChI Key: InChIKey=QOGDNNNOYQGADR-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50466999   
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))		BDBM50466999
PNG
(CHEMBL4294059)
Show SMILES Clc1cccc(c1)-c1ncsc1C(=O)c1ccccc1Cl
Show InChI InChI=1S/C16H9Cl2NOS/c17-11-5-3-4-10(8-11)14-16(21-9-19-14)15(20)12-6-1-2-7-13(12)18/h1-9H
PDB
MMDB

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Article
PubMed
n/an/a 2.40E+3n/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) after 1...

Bioorg Med Chem Lett 28: 3210-3215 (2018)


Article DOI: 10.1016/j.bmcl.2018.08.017
BindingDB Entry DOI: 10.7270/Q2KW5JPB
More data for this
Ligand-Target Pair