BDBM50197697 ({[({[(2R,3S,4R,5R)-5-(1,3-benzothiazol-2-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid::CHEMBL241481

SMILES: O[C@@H]1[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]([C@@H]1O)c1nc2ccccc2s1

InChI Key: InChIKey=CIAGCYTVMPWBBD-QCNRFFRDSA-N

Data: 3 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 3 hits for monomerid = 50197697   

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 2 (Homo sapiens (Human))	BDBM50197697 (({[({[(2R,3S,4R,5R)-5-(1,3-benzothiazol-2-yl)-3,4-...) Show SMILES O[C@@H]1[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]([C@@H]1O)c1nc2ccccc2s1 |w:9.9,5.5| Show InChI InChI=1S/C12H16NO13P3S/c14-9-7(5-23-28(19,20)26-29(21,22)25-27(16,17)18)24-11(10(9)15)12-13-6-3-1-2-4-8(6)30-12/h1-4,7,9-11,14-15H,5H2,(H,19,20)(H,21,22)(H2,16,17,18)/t7-,9-,10-,11-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	22	n/a	n/a	n/a	n/a
UCB-Group Curated by ChEMBL					Assay Description Agonist activity at human P2Y2 receptor expressed in human 1321N1 by FLIPR assay				Bioorg Med Chem Lett 17: 558-61 (2007) Article DOI: 10.1016/j.bmcl.2006.10.038 BindingDB Entry DOI: 10.7270/Q2QN67MX
					More data for this Ligand-Target Pair
P2Y purinoceptor 4 (Homo sapiens (Human))	BDBM50197697 (({[({[(2R,3S,4R,5R)-5-(1,3-benzothiazol-2-yl)-3,4-...) Show SMILES O[C@@H]1[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]([C@@H]1O)c1nc2ccccc2s1 |w:9.9,5.5| Show InChI InChI=1S/C12H16NO13P3S/c14-9-7(5-23-28(19,20)26-29(21,22)25-27(16,17)18)24-11(10(9)15)12-13-6-3-1-2-4-8(6)30-12/h1-4,7,9-11,14-15H,5H2,(H,19,20)(H,21,22)(H2,16,17,18)/t7-,9-,10-,11-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	4.12E+3	n/a	n/a	n/a	n/a
UCB-Group Curated by ChEMBL					Assay Description Agonist activity at human cloned P2Y4 receptor expressed in human 1321N1 by FLIPR assay				Bioorg Med Chem Lett 17: 558-61 (2007) Article DOI: 10.1016/j.bmcl.2006.10.038 BindingDB Entry DOI: 10.7270/Q2QN67MX
					More data for this Ligand-Target Pair
P2Y purinoceptor 1 (Homo sapiens (Human))	BDBM50197697 (({[({[(2R,3S,4R,5R)-5-(1,3-benzothiazol-2-yl)-3,4-...) Show SMILES O[C@@H]1[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]([C@@H]1O)c1nc2ccccc2s1 |w:9.9,5.5| Show InChI InChI=1S/C12H16NO13P3S/c14-9-7(5-23-28(19,20)26-29(21,22)25-27(16,17)18)24-11(10(9)15)12-13-6-3-1-2-4-8(6)30-12/h1-4,7,9-11,14-15H,5H2,(H,19,20)(H,21,22)(H2,16,17,18)/t7-,9-,10-,11-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a
UCB-Group Curated by ChEMBL					Assay Description Agonist activity at human cloned P2Y1 receptor expressed in human 1321N1 by FLIPR assay				Bioorg Med Chem Lett 17: 558-61 (2007) Article DOI: 10.1016/j.bmcl.2006.10.038 BindingDB Entry DOI: 10.7270/Q2QN67MX
					More data for this Ligand-Target Pair