BDBM50438485 CHEMBL2414630

SMILES: OP(O)(=O)CCCCCNCc1c[nH]c2c1nc[nH]c2=O

InChI Key: InChIKey=RSQVLAYEMSSQNQ-UHFFFAOYSA-N

Data: 1 KI

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 = 50438485   

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
Hypoxanthine-guanine phosphoribosyltransferase (HGPRT) (Homo sapiens (Human))	BDBM50438485 (CHEMBL2414630) Show SMILES OP(O)(=O)CCCCCNCc1c[nH]c2c1nc[nH]c2=O Show InChI InChI=1S/C12H19N4O4P/c17-12-11-10(15-8-16-12)9(7-14-11)6-13-4-2-1-3-5-21(18,19)20/h7-8,13-14H,1-6H2,(H,15,16,17)(H2,18,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Industrial Research Ltd Curated by ChEMBL					Assay Description Inhibition of human HGPRT using xanthine/PRPP assessed as xanthine/guanine conversion to xanthosine-5'-monophosphate/guanosine-5'-monophosphate by sp...				Bioorg Med Chem 21: 5629-46 (2013) Article DOI: 10.1016/j.bmc.2013.02.016 BindingDB Entry DOI: 10.7270/Q2N58NSF
					More data for this Ligand-Target Pair