BDBM50316223 3-(6-Amino-purin-9-ylmethyl)-5-cyclohexylmethoxy-benzene-1,2-diol::CHEMBL1098945

SMILES: Nc1ncnc2n(Cc3cc(OCC4CCCCC4)cc(O)c3O)cnc12

InChI Key: InChIKey=RAJFCEYNWSQDMP-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 = 50316223   

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
Adenosylhomocysteinase (Homo sapiens (Human))	BDBM50316223 (3-(6-Amino-purin-9-ylmethyl)-5-cyclohexylmethoxy-b...) Show SMILES Nc1ncnc2n(Cc3cc(OCC4CCCCC4)cc(O)c3O)cnc12 Show InChI InChI=1S/C19H23N5O3/c20-18-16-19(22-10-21-18)24(11-23-16)8-13-6-14(7-15(25)17(13)26)27-9-12-4-2-1-3-5-12/h6-7,10-12,25-26H,1-5,8-9H2,(H2,20,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
Boston College Curated by ChEMBL					Assay Description Inhibition of S-adenosyl-L-homocysteine hydrolase after 10 mins by scintillation counting				Bioorg Med Chem 17: 6707-14 (2009) Article DOI: 10.1016/j.bmc.2009.07.061 BindingDB Entry DOI: 10.7270/Q2JD4X0D
					More data for this Ligand-Target Pair