BDBM50048050 2-Amino-7-cyclohex-1-enyl-3,5-dihydro-pyrrolo[3,2-d]pyrimidin-4-one::CHEMBL301203

SMILES: Nc1nc2c(c[nH]c2c(=O)[nH]1)C1=CCCCC1

InChI Key: InChIKey=VWZFXCVUFKBULH-UHFFFAOYSA-N

Data: 2 KI  3 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 5 hits for monomerid = 50048050   

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 (PNP) (Bos taurus (bovine))	BDBM50048050 (2-Amino-7-cyclohex-1-enyl-3,5-dihydro-pyrrolo[3,2-...) Show SMILES Nc1nc2c(c[nH]c2c(=O)[nH]1)C1=CCCCC1 |t:13| Show InChI InChI=1S/C12H14N4O/c13-12-15-9-8(7-4-2-1-3-5-7)6-14-10(9)11(17)16-12/h4,6,14H,1-3,5H2,(H3,13,15,16,17)	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	500	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Inhibitory activity against calf spleen purine nucleoside phosphorylase (PNP) using 2-amino-6-mercapto-7-methyl purine ribonucleoside (MESG) as subst...				J Med Chem 42: 2422-31 (1999) Article DOI: 10.1021/jm990037y BindingDB Entry DOI: 10.7270/Q2CR5SKN
					More data for this Ligand-Target Pair
Purine Nucleoside Phosphorylase (PNP) (Bos taurus (bovine))	BDBM50048050 (2-Amino-7-cyclohex-1-enyl-3,5-dihydro-pyrrolo[3,2-...) Show SMILES Nc1nc2c(c[nH]c2c(=O)[nH]1)C1=CCCCC1 |t:13| Show InChI InChI=1S/C12H14N4O/c13-12-15-9-8(7-4-2-1-3-5-7)6-14-10(9)11(17)16-12/h4,6,14H,1-3,5H2,(H3,13,15,16,17)	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	862	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Inhibitory activity against calf spleen purine nucleoside phosphorylase (PNP) using inosine as substrate at a concentration of 10 uM.				J Med Chem 42: 2422-31 (1999) Article DOI: 10.1021/jm990037y BindingDB Entry DOI: 10.7270/Q2CR5SKN
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Bos taurus (bovine))	BDBM50048050 (2-Amino-7-cyclohex-1-enyl-3,5-dihydro-pyrrolo[3,2-...) Show SMILES Nc1nc2c(c[nH]c2c(=O)[nH]1)C1=CCCCC1 |t:13| Show InChI InChI=1S/C12H14N4O/c13-12-15-9-8(7-4-2-1-3-5-7)6-14-10(9)11(17)16-12/h4,6,14H,1-3,5H2,(H3,13,15,16,17)	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	n/a	n/a	1.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
BioCryst Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Inhibition of purine nucleoside phosphorylase from calf spleen in 50 mM phosphate				J Med Chem 36: 1847-54 (1993) BindingDB Entry DOI: 10.7270/Q2WQ02WD
					More data for this Ligand-Target Pair
Purine Nucleoside Phosphorylase (PNP) (Bos taurus (bovine))	BDBM50048050 (2-Amino-7-cyclohex-1-enyl-3,5-dihydro-pyrrolo[3,2-...) Show SMILES Nc1nc2c(c[nH]c2c(=O)[nH]1)C1=CCCCC1 |t:13| Show InChI InChI=1S/C12H14N4O/c13-12-15-9-8(7-4-2-1-3-5-7)6-14-10(9)11(17)16-12/h4,6,14H,1-3,5H2,(H3,13,15,16,17)	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
BioCryst Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description In vitro inhibition of purine nucleoside phosphorylase from calf spleen in 1 mM phosphate				J Med Chem 36: 1847-54 (1993) BindingDB Entry DOI: 10.7270/Q2WQ02WD
					More data for this Ligand-Target Pair
Purine Nucleoside Phosphorylase (PNP) (Bos taurus (bovine))	BDBM50048050 (2-Amino-7-cyclohex-1-enyl-3,5-dihydro-pyrrolo[3,2-...) Show SMILES Nc1nc2c(c[nH]c2c(=O)[nH]1)C1=CCCCC1 |t:13| Show InChI InChI=1S/C12H14N4O/c13-12-15-9-8(7-4-2-1-3-5-7)6-14-10(9)11(17)16-12/h4,6,14H,1-3,5H2,(H3,13,15,16,17)	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	1.97E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Inhibitory activity against calf spleen purine nucleoside phosphorylase (PNP) using inosine as substrate at a concentration of 10 uM.				J Med Chem 42: 2422-31 (1999) Article DOI: 10.1021/jm990037y BindingDB Entry DOI: 10.7270/Q2CR5SKN
					More data for this Ligand-Target Pair