BDBM50085818 CHEMBL166163::N6-Methyl-1,5-anhydro-2-(adenin-9-yl)-2,3-dideoxy-D-arabino-hexitol-6-triphosphate Tetraammonium

SMILES: CNc1ncnc2n(cnc12)C1COC(COP(O)(=O)OP(O)(=O)OP(O)(O)=O)C(O)C1

InChI Key: InChIKey=OQJXSRJQGJTXKF-UHFFFAOYSA-N

Data: 1 IC50  1 EC50

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 2 hits for monomerid = 50085818   

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
P2Y purinoceptor 1 (Meleagris gallopavo)	BDBM50085818 (CHEMBL166163 | N6-Methyl-1,5-anhydro-2-(adenin-9-y...) Show SMILES CNc1ncnc2n(cnc12)C1COC(COP(O)(=O)OP(O)(=O)OP(O)(O)=O)C(O)C1 Show InChI InChI=1S/C12H20N5O12P3/c1-13-11-10-12(15-5-14-11)17(6-16-10)7-2-8(18)9(26-3-7)4-27-31(22,23)29-32(24,25)28-30(19,20)21/h5-9,18H,2-4H2,1H3,(H,22,23)(H,24,25)(H,13,14,15)(H2,19,20,21)	MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	9.35E+3	n/a	n/a	n/a	n/a
National Institute of Diabetes Curated by ChEMBL					Assay Description In vitro stimulation of 2PY1 purinoceptor mediated phospholipase C (PLC) activity in Turkey Erythrocyte Ghosts				J Med Chem 43: 829-42 (2000) BindingDB Entry DOI: 10.7270/Q2474BJ3
					More data for this Ligand-Target Pair
P2Y purinoceptor 1 (Meleagris gallopavo)	BDBM50085818 (CHEMBL166163 | N6-Methyl-1,5-anhydro-2-(adenin-9-y...) Show SMILES CNc1ncnc2n(cnc12)C1COC(COP(O)(=O)OP(O)(=O)OP(O)(O)=O)C(O)C1 Show InChI InChI=1S/C12H20N5O12P3/c1-13-11-10-12(15-5-14-11)17(6-16-10)7-2-8(18)9(26-3-7)4-27-31(22,23)29-32(24,25)28-30(19,20)21/h5-9,18H,2-4H2,1H3,(H,22,23)(H,24,25)(H,13,14,15)(H2,19,20,21)	MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.37E+3	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Diabetes Curated by ChEMBL					Assay Description Inhibition of 30 nM 2-MeSADP stimulation of 2PY1-mediated phospholipase C (PLC) activity in Turkey erythocyte ghosts				J Med Chem 43: 829-42 (2000) BindingDB Entry DOI: 10.7270/Q2474BJ3
					More data for this Ligand-Target Pair