BDBM50446383 CHEMBL3109634

SMILES: COc1cc2c(cc1OCCCN1CC(F)C1)N=C(N)C21CCC1

InChI Key: InChIKey=LGLQVJRIGQYVNJ-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50446383   

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
Protein G9a (G9a) (Homo sapiens (Human))	BDBM50446383 (CHEMBL3109634) Show SMILES COc1cc2c(cc1OCCCN1CC(F)C1)N=C(N)C21CCC1 |t:19| Show InChI InChI=1S/C18H24FN3O2/c1-23-15-8-13-14(21-17(20)18(13)4-2-5-18)9-16(15)24-7-3-6-22-10-12(19)11-22/h8-9,12H,2-7,10-11H2,1H3,(H2,20,21)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.80	n/a	n/a	n/a	n/a	n/a	n/a
AbbVie Inc. Curated by ChEMBL					Assay Description Inhibition of G9a (unknown origin) using biotinylated-histone H3(1-21) peptide as substrate after 3 hrs by AlphaLISA assay				ACS Med Chem Lett 5: 205-9 (2014) Article DOI: 10.1021/ml400496h BindingDB Entry DOI: 10.7270/Q2FT8NJ0
					More data for this Ligand-Target Pair