BDBM50027447 CHEMBL1229561::CHEMBL167729::Phosphoric acid mono-[5-(6-amino-purin-9-yl)-3-hydroxy-4-methoxy-tetrahydro-furan-2-ylmethyl] ester

SMILES: CO[C@@H]1[C@H](O)[C@@H](COP(O)(O)=O)O[C@H]1n1cnc2c(N)ncnc12

InChI Key: InChIKey=TVGFEBXIZUYVFR-UHFFFAOYSA-N

Data: 3 KI

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 3 hits for monomerid = 50027447   

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
Adenylate kinase 2 (Rattus norvegicus)	BDBM50027447 (CHEMBL1229561 | Phosphoric acid mono-[5-(6-amino-p...) Show SMILES CO[C@@H]1[C@H](O)[C@@H](COP(O)(O)=O)O[C@H]1n1cnc2c(N)ncnc12 |r| Show InChI InChI=1S/C11H16N5O7P/c1-21-8-7(17)5(2-22-24(18,19)20)23-11(8)16-4-15-6-9(12)13-3-14-10(6)16/h3-5,7-8,11,17H,2H2,1H3,(H2,12,13,14)(H2,18,19,20)	PDB KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.60E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Competitive inhibitory constant with Rat adenylate kinase II isozyme				J Med Chem 25: 806-12 (1982) BindingDB Entry DOI: 10.7270/Q2765FWS
					More data for this Ligand-Target Pair
Adenylate kinase 1 (Rattus norvegicus)	BDBM50027447 (CHEMBL1229561 | Phosphoric acid mono-[5-(6-amino-p...) Show SMILES CO[C@@H]1[C@H](O)[C@@H](COP(O)(O)=O)O[C@H]1n1cnc2c(N)ncnc12 |r| Show InChI InChI=1S/C11H16N5O7P/c1-21-8-7(17)5(2-22-24(18,19)20)23-11(8)16-4-15-6-9(12)13-3-14-10(6)16/h3-5,7-8,11,17H,2H2,1H3,(H2,12,13,14)(H2,18,19,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4.10E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Competitive inhibitory constant with Rat adenylate kinase M isozyme				J Med Chem 25: 806-12 (1982) BindingDB Entry DOI: 10.7270/Q2765FWS
					More data for this Ligand-Target Pair
Adenylate kinase 3 alpha like 1 (Rattus norvegicus)	BDBM50027447 (CHEMBL1229561 | Phosphoric acid mono-[5-(6-amino-p...) Show SMILES CO[C@@H]1[C@H](O)[C@@H](COP(O)(O)=O)O[C@H]1n1cnc2c(N)ncnc12 |r| Show InChI InChI=1S/C11H16N5O7P/c1-21-8-7(17)5(2-22-24(18,19)20)23-11(8)16-4-15-6-9(12)13-3-14-10(6)16/h3-5,7-8,11,17H,2H2,1H3,(H2,12,13,14)(H2,18,19,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4.80E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Competitive inhibitory constant with Rat adenylate kinase III				J Med Chem 25: 806-12 (1982) BindingDB Entry DOI: 10.7270/Q2765FWS
					More data for this Ligand-Target Pair