BDBM92930 Immucillins, 14

SMILES: O[C@@H]1CN(Cc2c[nH]c3c2nc[nH]c3=O)C[C@H]1O

InChI Key: InChIKey=HLFZIUSTFPPWRR-HTQZYQBOSA-N

Data: 1 Kd  2 ITC

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 = 92930   

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
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM92930 (Immucillins, 14) Show SMILES O[C@@H]1CN(Cc2c[nH]c3c2nc[nH]c3=O)C[C@H]1O |r| Show InChI InChI=1S/C11H12N4O3/c16-7-3-15(4-8(7)17)2-6-1-12-10-9(6)13-5-14-11(10)18/h1,5,7-8,16-17H,2-4H2/t7-,8-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	53	n/a	n/a	n/a	n/a	n/a
Albert Einstein College of Medicine					Assay Description Inhibition assay using human PNP.				Biochemistry 48: 5226-38 (2009) Article DOI: 10.1021/bi9005896 BindingDB Entry DOI: 10.7270/Q2SB44C9
					More data for this Ligand-Target Pair

Activity Spreadsheet -- ITC Data from BindingDB

Found 2 hits for monomerid = 92930

Cell (A)	Syringe (B)	Cell Links	Syringe Links	Cell + Syr Links	ΔG° kcal/mole	-TΔS° kcal/mole	ΔH° kcal/mole	log K	pH	Temp °C
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM92930 (Immucillins, 14)	DrugBank GoogleScholar KEGG PDB	PC cid PC sid		-10.0	n/a	n/a	7.34	7.40	25
Albert Einstein College of Medicine					Biochemistry 48: 5226-38 (2009)
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM92930 (Immucillins, 14)	DrugBank GoogleScholar KEGG PDB	PC cid PC sid		n/a	n/a	-8.60	n/a	7.40	27
Albert Einstein College of Medicine					Biochemistry 48: 5226-38 (2009)