BDBM50031329 CHEMBL3358017

SMILES: O[C@@H](CNCCc1c[nH]c2ccccc12)Cn1c2ccccc2c2ccccc12

InChI Key: InChIKey=LJWMTSMUQJNHOC-IBGZPJMESA-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 = 50031329   

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
DNA (cytosine-5)-methyltransferase 1 (Mus musculus)	BDBM50031329 (CHEMBL3358017) Show SMILES O[C@@H](CNCCc1c[nH]c2ccccc12)Cn1c2ccccc2c2ccccc12 |r| Show InChI InChI=1S/C25H25N3O/c29-19(16-26-14-13-18-15-27-23-10-4-1-7-20(18)23)17-28-24-11-5-2-8-21(24)22-9-3-6-12-25(22)28/h1-12,15,19,26-27,29H,13-14,16-17H2/t19-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.56E+4	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of N-terminal His6-tagged mouse DNMT1 (731 to 1602 residues) expressed in Escherichia coli BL21 (DE3) incubated for 15 mins before additio...				J Med Chem 57: 9028-41 (2014) Article DOI: 10.1021/jm501134e BindingDB Entry DOI: 10.7270/Q2JD4ZD6
					More data for this Ligand-Target Pair