BDBM50057731 (2-Carbamoyl-3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yl)-carbamic acid methyl ester::CHEMBL133097

SMILES: COC(=O)N[C@@]1(O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(N)=O

InChI Key: InChIKey=ZQTAMPRAONLFQI-FMTWGGRWSA-N

Data: 6 KI

PDB links: 2 PDB IDs match this monomer.

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 6 hits for monomerid = 50057731   

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))	BDBM50057731 ((2-Carbamoyl-3,4,5-trihydroxy-6-hydroxymethyl-tetr...) Show SMILES COC(=O)N[C@@]1(O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(N)=O |r| Show InChI InChI=1S/C9H16N2O8/c1-18-8(17)11-9(7(10)16)6(15)5(14)4(13)3(2-12)19-9/h3-6,12-15H,2H2,1H3,(H2,10,16)(H,11,17)/t3-,4-,5+,6-,9+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	1.58E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Alcala Curated by ChEMBL					Assay Description Inhibitory activity against rabbit muscle glycogen phosphorylase				J Med Chem 40: 4089-102 (1998) Checked by Author Article DOI: 10.1021/jm970273d BindingDB Entry DOI: 10.7270/Q2S46TGM
					More data for this Ligand-Target Pair				3D Structure (crystal)
Muscle glycogen phosphorylase (Homo sapiens (Human))	BDBM50057731 ((2-Carbamoyl-3,4,5-trihydroxy-6-hydroxymethyl-tetr...) Show SMILES COC(=O)N[C@@]1(O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(N)=O |r| Show InChI InChI=1S/C9H16N2O8/c1-18-8(17)11-9(7(10)16)6(15)5(14)4(13)3(2-12)19-9/h3-6,12-15H,2H2,1H3,(H2,10,16)(H,11,17)/t3-,4-,5+,6-,9+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	1.58E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Alcala Curated by ChEMBL					Assay Description Inhibitory activity against rabbit muscle glycogen phosphorylase				J Med Chem 40: 4089-102 (1998) Checked by Author Article DOI: 10.1021/jm970273d BindingDB Entry DOI: 10.7270/Q2S46TGM
					More data for this Ligand-Target Pair				3D Structure (crystal)
Glycogen phosphorylase, muscle form (Oryctolagus cuniculus (rabbit))	BDBM50057731 ((2-Carbamoyl-3,4,5-trihydroxy-6-hydroxymethyl-tetr...) Show SMILES COC(=O)N[C@@]1(O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(N)=O |r| Show InChI InChI=1S/C9H16N2O8/c1-18-8(17)11-9(7(10)16)6(15)5(14)4(13)3(2-12)19-9/h3-6,12-15H,2H2,1H3,(H2,10,16)(H,11,17)/t3-,4-,5+,6-,9+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	1.60E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Debrecen Curated by ChEMBL					Assay Description Inhibition of rabbit skeletal muscle glycogen phosphorylase b by Dixon plot				Bioorg Med Chem 18: 1171-80 (2010) Article DOI: 10.1016/j.bmc.2009.12.043 BindingDB Entry DOI: 10.7270/Q2JQ114D
					More data for this Ligand-Target Pair				3D Structure (crystal)
Glycogen phosphorylase, muscle form (Oryctolagus cuniculus (rabbit))	BDBM50057731 ((2-Carbamoyl-3,4,5-trihydroxy-6-hydroxymethyl-tetr...) Show SMILES COC(=O)N[C@@]1(O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(N)=O |r| Show InChI InChI=1S/C9H16N2O8/c1-18-8(17)11-9(7(10)16)6(15)5(14)4(13)3(2-12)19-9/h3-6,12-15H,2H2,1H3,(H2,10,16)(H,11,17)/t3-,4-,5+,6-,9+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	1.60E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Debrecen Curated by ChEMBL					Assay Description Inhibition of rabbit skeletal muscle glycogen phosphorylase b				Bioorg Med Chem 18: 1171-80 (2010) Article DOI: 10.1016/j.bmc.2009.12.043 BindingDB Entry DOI: 10.7270/Q2JQ114D
					More data for this Ligand-Target Pair				3D Structure (crystal)
Brain glycogen phosphorylase (Homo sapiens (Human))	BDBM50057731 ((2-Carbamoyl-3,4,5-trihydroxy-6-hydroxymethyl-tetr...) Show SMILES COC(=O)N[C@@]1(O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(N)=O |r| Show InChI InChI=1S/C9H16N2O8/c1-18-8(17)11-9(7(10)16)6(15)5(14)4(13)3(2-12)19-9/h3-6,12-15H,2H2,1H3,(H2,10,16)(H,11,17)/t3-,4-,5+,6-,9+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	1.60E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Perugia Curated by ChEMBL					Assay Description Inhibition of rabbit glycogen phosphorylase B enzyme				J Med Chem 40: 1455-64 (1997) Article DOI: 10.1021/jm9608016 BindingDB Entry DOI: 10.7270/Q26T0N9N
					More data for this Ligand-Target Pair
Brain glycogen phosphorylase (Homo sapiens (Human))	BDBM50057731 ((2-Carbamoyl-3,4,5-trihydroxy-6-hydroxymethyl-tetr...) Show SMILES COC(=O)N[C@@]1(O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(N)=O |r| Show InChI InChI=1S/C9H16N2O8/c1-18-8(17)11-9(7(10)16)6(15)5(14)4(13)3(2-12)19-9/h3-6,12-15H,2H2,1H3,(H2,10,16)(H,11,17)/t3-,4-,5+,6-,9+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	6.31E+13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Philipps-Universit£t Marburg Curated by ChEMBL					Assay Description Inhibitory activity against Pig Skeletal Glycogen Phosphorylase b				J Med Chem 45: 4153-70 (2002) Article DOI: 10.1021/jm020808p BindingDB Entry DOI: 10.7270/Q2KH0R3H
					More data for this Ligand-Target Pair