BDBM50386288 CHEMBL2041081
SMILES: OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)n1cc(Cl)c(=O)[nH]c1=O
InChI Key: InChIKey=NONSBAHWXCNSII-XSEHCYKFSA-N
Data: 2 KI
PDB links: 1 PDB ID matches this monomer.
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50386288 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 |
Muscle glycogen phosphorylase
(Homo sapiens (Human)) | BDBM50386288
 (CHEMBL2041081)Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)n1cc(Cl)c(=O)[nH]c1=O Show InChI InChI=1S/C10H13ClN2O7/c11-3-1-13(10(19)12-8(3)18)9-7(17)6(16)5(15)4(2-14)20-9/h1,4-7,9,14-17H,2H2,(H,12,18,19)/t4-,5-,6+,7-,9-/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar
| CHEMBL MMDB PC cid PC sid PDB UniChem
Similars
| PDB Article PubMed
| 1.02E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Thessaly
Curated by ChEMBL
| Assay Description Inhibition of glycogen phosphorylase b |
Eur J Med Chem 54: 740-9 (2012)
Article DOI: 10.1016/j.ejmech.2012.06.029 BindingDB Entry DOI: 10.7270/Q2VX0HKH |
More data for this Ligand-Target Pair |  3D Structure (crystal) |
Glycogen phosphorylase, muscle form
(Oryctolagus cuniculus (rabbit)) | BDBM50386288
 (CHEMBL2041081)Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)n1cc(Cl)c(=O)[nH]c1=O Show InChI InChI=1S/C10H13ClN2O7/c11-3-1-13(10(19)12-8(3)18)9-7(17)6(16)5(15)4(2-14)20-9/h1,4-7,9,14-17H,2H2,(H,12,18,19)/t4-,5-,6+,7-,9-/m1/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank GoogleScholar
| CHEMBL MMDB PC cid PC sid PDB UniChem
Similars
| PDB Article PubMed
| 1.02E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Thessaly
Curated by ChEMBL
| Assay Description Competitive inhibition of rabbit skeletal muscle glycogen phosphorylase b using Glc-1-P as substrate |
Eur J Med Chem 54: 740-9 (2012)
Article DOI: 10.1016/j.ejmech.2012.06.029 BindingDB Entry DOI: 10.7270/Q2VX0HKH |
More data for this Ligand-Target Pair |  3D Structure (crystal) |