BDBM50360113 CHEMBL1928781

SMILES: OP(O)(=O)CCCCn1cnc2c1nc[nH]c2=O

InChI Key: InChIKey=SXKIHSHTTWSCGF-UHFFFAOYSA-N

Data: 1 KI

PDB links: 1 PDB ID matches this monomer.

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 = 50360113   

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))	BDBM50360113 (CHEMBL1928781) Show SMILES OP(O)(=O)CCCCn1cnc2c1nc[nH]c2=O Show InChI InChI=1S/C9H13N4O4P/c14-9-7-8(10-5-11-9)13(6-12-7)3-1-2-4-18(15,16)17/h5-6H,1-4H2,(H,10,11,14)(H2,15,16,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Academy of Sciences of Czech Republic Curated by ChEMBL					Assay Description Inhibition of human HGPRT				Bioorg Med Chem 20: 1076-89 (2012) Article DOI: 10.1016/j.bmc.2011.11.034 BindingDB Entry DOI: 10.7270/Q2RV0P44
					More data for this Ligand-Target Pair