BDBM50162073 (S)-2-((2-amino-6-oxo-3H-purin-9(6H)-yl)methoxy)ethyl 2-amino-3-methylbutanoate::(S)-2-Amino-3-methyl-butyric acid 2-(2-amino-6-oxo-1,6-dihydro-purin-9-ylmethoxy)-ethyl ester::CHEMBL1349::VALACYCLOVIR

SMILES: CC(C)[C@@H](C(=O)OCCOCn1cnc2c1N=C(NC2=O)N)N

InChI Key: InChIKey=HDOVUKNUBWVHOX-UHFFFAOYSA-N

Data: 9 KI  5 IC50

PDB links: 2 PDB IDs match 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 14 hits for monomerid = 50162073   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Solute carrier family 15 member 1 (Human)	BDBM50162073 ((S)-2-((2-amino-6-oxo-3H-purin-9(6H)-yl)methoxy)et...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.42E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Solute carrier family 15 member 1 (Human)	BDBM50162073 ((S)-2-((2-amino-6-oxo-3H-purin-9(6H)-yl)methoxy)et...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.31E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Solute carrier family 15 member 1 (Human)	BDBM50162073 ((S)-2-((2-amino-6-oxo-3H-purin-9(6H)-yl)methoxy)et...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Solute carrier family 15 member 1 (Human)	BDBM50162073 ((S)-2-((2-amino-6-oxo-3H-purin-9(6H)-yl)methoxy)et...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.40E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Solute carrier family 15 member 1 (Human)	BDBM50162073 ((S)-2-((2-amino-6-oxo-3H-purin-9(6H)-yl)methoxy)et...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.10E+6	n/a	n/a	n/a	n/a	n/a	n/a
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Solute carrier family 15 member 2 (Rat)	BDBM50162073 ((S)-2-((2-amino-6-oxo-3H-purin-9(6H)-yl)methoxy)et...) Show SMILES Show InChI	GoogleScholar	UniChem		1.70E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Solute carrier family 15 member 2 (Rat)	BDBM50162073 ((S)-2-((2-amino-6-oxo-3H-purin-9(6H)-yl)methoxy)et...) Show SMILES Show InChI	GoogleScholar	UniChem		2.20E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Solute carrier family 15 member 2 (Rat)	BDBM50162073 ((S)-2-((2-amino-6-oxo-3H-purin-9(6H)-yl)methoxy)et...) Show SMILES Show InChI	GoogleScholar	UniChem		2.20E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Solute carrier family 15 member 2 (Rat)	BDBM50162073 ((S)-2-((2-amino-6-oxo-3H-purin-9(6H)-yl)methoxy)et...) Show SMILES Show InChI	GoogleScholar	UniChem		3.90E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Solute carrier family 15 member 1 (Human)	BDBM50162073 ((S)-2-((2-amino-6-oxo-3H-purin-9(6H)-yl)methoxy)et...) Show SMILES Show InChI	GoogleScholar	UniChem		4.90E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Solute carrier family 15 member 1 (Human)	BDBM50162073 ((S)-2-((2-amino-6-oxo-3H-purin-9(6H)-yl)methoxy)et...) Show SMILES Show InChI	GoogleScholar	UniChem		7.40E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Solute carrier family 15 member 1 (Rat)	BDBM50162073 ((S)-2-((2-amino-6-oxo-3H-purin-9(6H)-yl)methoxy)et...) Show SMILES Show InChI	GoogleScholar	UniChem		2.50E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Solute carrier family 15 member 1 (Rat)	BDBM50162073 ((S)-2-((2-amino-6-oxo-3H-purin-9(6H)-yl)methoxy)et...) Show SMILES Show InChI	GoogleScholar	UniChem		2.70E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Solute carrier family 15 member 1 (Human)	BDBM50162073 ((S)-2-((2-amino-6-oxo-3H-purin-9(6H)-yl)methoxy)et...) Show SMILES Show InChI	GoogleScholar	UniChem		4.08E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair