BDBM50064801 2-(4,7-Dihydroxy-3-methyl-7-oxo-5,9-dihydro-6,8-dioxa-2-aza-7lambda*5*-phospha-benzocyclohepten-1-ylazo)-benzene-1,4-disulfonic acid::CHEMBL304765
SMILES: Cc1nc(N=Nc2cc(ccc2S(O)(=O)=O)S(O)(=O)=O)c2COP(O)(=O)OCc2c1O
InChI Key: InChIKey=GGJCEYXTBFQGRQ-UHFFFAOYSA-N
Data: 4 IC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
P2X purinoceptor 1 (RAT) | BDBM50064801 (2-(4,7-Dihydroxy-3-methyl-7-oxo-5,9-dihydro-6,8-di...) | Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 1.02E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL | Assay Description Compound was tested in a functional ion channel assay of ATP-induced current at recombinant rat P2X1 receptor expressed in Xenopus oocytes. | J Med Chem 41: 2201-6 (1998) Article DOI: 10.1021/jm980183o BindingDB Entry DOI: 10.7270/Q2DB80ZC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
P2X purinoceptor 1 (RAT) | BDBM50064801 (2-(4,7-Dihydroxy-3-methyl-7-oxo-5,9-dihydro-6,8-di...) | Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 1.02E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL | Assay Description Inhibition of inward ion current elicited by ATP at P2X1 receptor expressed in Xenopus oocytes | J Med Chem 44: 340-9 (2001) BindingDB Entry DOI: 10.7270/Q2FN15HC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
P2X purinoceptor 3 (RAT) | BDBM50064801 (2-(4,7-Dihydroxy-3-methyl-7-oxo-5,9-dihydro-6,8-di...) | PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 5.83E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL | Assay Description Inhibition of inward ion current elicited by ATP was determined at recombinant P2X3 receptor expressed in Xenopus oocytes | J Med Chem 44: 340-9 (2001) BindingDB Entry DOI: 10.7270/Q2FN15HC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
P2X purinoceptor 3 (RAT) | BDBM50064801 (2-(4,7-Dihydroxy-3-methyl-7-oxo-5,9-dihydro-6,8-di...) | PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 5.83E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL | Assay Description Compound was tested in a functional ion channel assay of ATP-induced current at recombinant rat P2X3 receptor expressed in Xenopus oocytes. | J Med Chem 41: 2201-6 (1998) Article DOI: 10.1021/jm980183o BindingDB Entry DOI: 10.7270/Q2DB80ZC | |||||||||||
More data for this Ligand-Target Pair |