BDBM50021776 2-Amino-9-(2-hydroxy-ethoxymethyl)-5,9-dihydro-purin-6-one::2-Amino-9-(2-hydroxy-ethoxymethyl)-5,9-dihydro-purin-6-one (ACV)::ACYCLOVIR::CHEMBL279075

SMILES: c1nc2c(n1COCCO)N=C(NC2=O)N

InChI Key: InChIKey=MKUXAQIIEYXACX-UHFFFAOYSA-N

Data: 3 KI  3 IC50  1 Kd

PDB links: 8 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 7 hits for monomerid = 50021776   

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
Thymidine kinase (HHV-1)	BDBM50021776 (ACYCLOVIR | 2-Amino-9-(2-hydroxy-ethoxymethyl)-5,9...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.22E+5	n/a	n/a	n/a	n/a	n/a	n/a
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Thymidine kinase (HHV-2)	BDBM50021776 (ACYCLOVIR | 2-Amino-9-(2-hydroxy-ethoxymethyl)-5,9...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
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Thymidine kinase (CeHV-1)	BDBM50021776 (ACYCLOVIR | 2-Amino-9-(2-hydroxy-ethoxymethyl)-5,9...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
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Purine nucleoside phosphorylase (Mycobacterium tuberculosis (strain ATCC 25618 / H3...)	BDBM50021776 (ACYCLOVIR | 2-Amino-9-(2-hydroxy-ethoxymethyl)-5,9...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	1.26E+4	n/a	n/a	n/a	n/a	n/a
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Thymidine kinase, cytosolic (Human)	BDBM50021776 (ACYCLOVIR | 2-Amino-9-(2-hydroxy-ethoxymethyl)-5,9...) Show SMILES Show InChI	GoogleScholar	UniChem		4.50E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Thymidine kinase, cytosolic (Human)	BDBM50021776 (ACYCLOVIR | 2-Amino-9-(2-hydroxy-ethoxymethyl)-5,9...) Show SMILES Show InChI	GoogleScholar	UniChem		1.80E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Purine nucleoside phosphorylase (Human)	BDBM50021776 (ACYCLOVIR | 2-Amino-9-(2-hydroxy-ethoxymethyl)-5,9...) Show SMILES Show InChI	GoogleScholar	UniChem		1.80E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair