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SMILES: COC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(Cl)cc1

InChI Key: InChIKey=CDSIWRGJSKHJRV-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50158812   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Lysine-specific demethylase 5B (Homo sapiens (Human))	BDBM50158812 (CHEMBL3786987) Show SMILES COC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(Cl)cc1 Show InChI InChI=1S/C17H14ClN3O3/c1-23-17(22)13-6-8-19-15(10-13)21-16(7-9-20-21)24-11-12-2-4-14(18)5-3-12/h2-10H,11H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
University of Oxford Curated by ChEMBL					Assay Description Inhibition of KDM5B in human ZR-75-1 cells assessed as reduction in H3K4me3 demethylation incubated for 72 hrs by fluorometric immunoassay				J Med Chem 59: 1308-29 (2016) BindingDB Entry DOI: 10.7270/Q2MP5559
					More data for this Ligand-Target Pair
Lysine-specific demethylase 5A (Homo sapiens (Human))	BDBM50158812 (CHEMBL3786987) Show SMILES COC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(Cl)cc1 Show InChI InChI=1S/C17H14ClN3O3/c1-23-17(22)13-6-8-19-15(10-13)21-16(7-9-20-21)24-11-12-2-4-14(18)5-3-12/h2-10H,11H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
University of Oxford Curated by ChEMBL					Assay Description Inhibition of KDM5A in human ZR-75-1 cells assessed as reduction in H3K4me3 demethylation incubated for 72 hrs by fluorometric immunoassay				J Med Chem 59: 1308-29 (2016) BindingDB Entry DOI: 10.7270/Q2MP5559
					More data for this Ligand-Target Pair