BDBM50346168 (R)-3-(pyrrolidin-2-ylethynyl)pyridine hemigalactarate::CHEMBL1782074::CHEMBL1783878::CHEMBL1783879::CHEMBL1783880::CHEMBL1783884

SMILES: O[C@@H]([C@@H](O)[C@H](O)C(O)=O)[C@@H](O)C(O)=O

InChI Key: InChIKey=DSLZVSRJTYRBFB-DUHBMQHGSA-N

Data: 5 KI

PDB links: 1 PDB ID matches 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 5 hits for monomerid = 50346168   

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
Neuronal acetylcholine receptor protein alpha-7 subunit (Mus musculus)	BDBM50346168 ((R)-3-(pyrrolidin-2-ylethynyl)pyridine hemigalacta...) Show SMILES O[C@@H]([C@@H](O)[C@H](O)C(O)=O)[C@@H](O)C(O)=O |r| Show InChI InChI=1S/C6H10O8/c7-1(3(9)5(11)12)2(8)4(10)6(13)14/h1-4,7-10H,(H,11,12)(H,13,14)/t1-,2+,3+,4-	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem	Article PubMed	733	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Targacept, Inc. Curated by ChEMBL					Assay Description Displacement of [125I]alpha-bungarotoxin from alpha7 nAChR in C57BL/6J mouse hippocampal membrane				Bioorg Med Chem Lett 19: 4359-63 (2009) Article DOI: 10.1016/j.bmcl.2009.05.085 BindingDB Entry DOI: 10.7270/Q2DJ5FZP
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor protein alpha-7 subunit (Mus musculus)	BDBM50346168 ((R)-3-(pyrrolidin-2-ylethynyl)pyridine hemigalacta...) Show SMILES O[C@@H]([C@@H](O)[C@H](O)C(O)=O)[C@@H](O)C(O)=O |r| Show InChI InChI=1S/C6H10O8/c7-1(3(9)5(11)12)2(8)4(10)6(13)14/h1-4,7-10H,(H,11,12)(H,13,14)/t1-,2+,3+,4-	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem	Article PubMed	5.77E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Targacept, Inc. Curated by ChEMBL					Assay Description Displacement of [125I]alpha-bungarotoxin from alpha7 nAChR in C57BL/6J mouse hippocampal membrane				Bioorg Med Chem Lett 19: 4359-63 (2009) Article DOI: 10.1016/j.bmcl.2009.05.085 BindingDB Entry DOI: 10.7270/Q2DJ5FZP
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor protein alpha-7 subunit (Mus musculus)	BDBM50346168 ((R)-3-(pyrrolidin-2-ylethynyl)pyridine hemigalacta...) Show SMILES O[C@@H]([C@@H](O)[C@H](O)C(O)=O)[C@@H](O)C(O)=O |r| Show InChI InChI=1S/C6H10O8/c7-1(3(9)5(11)12)2(8)4(10)6(13)14/h1-4,7-10H,(H,11,12)(H,13,14)/t1-,2+,3+,4-	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Targacept, Inc. Curated by ChEMBL					Assay Description Displacement of [125I]alpha-bungarotoxin from alpha7 nAChR in C57BL/6J mouse hippocampal membrane				Bioorg Med Chem Lett 19: 4359-63 (2009) Article DOI: 10.1016/j.bmcl.2009.05.085 BindingDB Entry DOI: 10.7270/Q2DJ5FZP
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor protein alpha-7 subunit (Mus musculus)	BDBM50346168 ((R)-3-(pyrrolidin-2-ylethynyl)pyridine hemigalacta...) Show SMILES O[C@@H]([C@@H](O)[C@H](O)C(O)=O)[C@@H](O)C(O)=O |r| Show InChI InChI=1S/C6H10O8/c7-1(3(9)5(11)12)2(8)4(10)6(13)14/h1-4,7-10H,(H,11,12)(H,13,14)/t1-,2+,3+,4-	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Targacept, Inc. Curated by ChEMBL					Assay Description Displacement of [125I]alpha-bungarotoxin from alpha7 nAChR in C57BL/6J mouse hippocampal membrane				Bioorg Med Chem Lett 19: 4359-63 (2009) Article DOI: 10.1016/j.bmcl.2009.05.085 BindingDB Entry DOI: 10.7270/Q2DJ5FZP
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor protein alpha-7 subunit (Mus musculus)	BDBM50346168 ((R)-3-(pyrrolidin-2-ylethynyl)pyridine hemigalacta...) Show SMILES O[C@@H]([C@@H](O)[C@H](O)C(O)=O)[C@@H](O)C(O)=O |r| Show InChI InChI=1S/C6H10O8/c7-1(3(9)5(11)12)2(8)4(10)6(13)14/h1-4,7-10H,(H,11,12)(H,13,14)/t1-,2+,3+,4-	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Targacept, Inc. Curated by ChEMBL					Assay Description Displacement of [125I]alpha-bungarotoxin from alpha7 nAChR in C57BL/6J mouse hippocampal membrane				Bioorg Med Chem Lett 19: 4359-63 (2009) Article DOI: 10.1016/j.bmcl.2009.05.085 BindingDB Entry DOI: 10.7270/Q2DJ5FZP
					More data for this Ligand-Target Pair