Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Nuclear receptor ROR-alpha' and Ligand = 'BDBM50434243'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Nuclear receptor ROR-alpha (Homo sapiens (Human))	BDBM50434243 (CHEMBL2385912) Show SMILES COc1cc(ccc1OCc1ccccc1Cl)C1NC(=O)N=C(C)C1C(C)=O |t:23| Show InChI InChI=1S/C21H21ClN2O4/c1-12-19(13(2)25)20(24-21(26)23-12)14-8-9-17(18(10-14)27-3)28-11-15-6-4-5-7-16(15)22/h4-10,19-20H,11H2,1-3H3,(H,24,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	2.82E+4	n/a	n/a	n/a	n/a
Genfit SA Curated by ChEMBL					Assay Description Partial agonist activity at GST-fussed RORalpha (unknown origin) assessed as recruitment of TIF2-BAP protein after overnight incubation by pull down ...				ACS Med Chem Lett 4: 504-8 (2013) Article DOI: 10.1021/ml300471d BindingDB Entry DOI: 10.7270/Q22R3T1B
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