Compile Data Set for Download or QSAR

Found 8 hits Enz. Inhib. hit(s) with Target = 'Solute carrier family 13 member 5' and Ligand = 'BDBM50149244'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Solute carrier family 13 member 5 (Rattus norvegicus)	BDBM50149244 (CHEMBL3771118) Show SMILES COc1ncc(C)cc1CC[C@@](O)(CC(O)=O)C(O)=O |r| Show InChI InChI=1S/C13H17NO6/c1-8-5-9(11(20-2)14-7-8)3-4-13(19,12(17)18)6-10(15)16/h5,7,19H,3-4,6H2,1-2H3,(H,15,16)(H,17,18)/t13-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of NaCT in rat hepatocytes assessed as [14C]-citrate uptake after 30 mins by scintillation counting method				J Med Chem 59: 1165-75 (2016) Article DOI: 10.1021/acs.jmedchem.5b01752 BindingDB Entry DOI: 10.7270/Q2ZW1NRC
					More data for this Ligand-Target Pair
Solute carrier family 13 member 5 (Rattus norvegicus)	BDBM50149244 (CHEMBL3771118) Show SMILES COc1ncc(C)cc1CC[C@@](O)(CC(O)=O)C(O)=O |r| Show InChI InChI=1S/C13H17NO6/c1-8-5-9(11(20-2)14-7-8)3-4-13(19,12(17)18)6-10(15)16/h5,7,19H,3-4,6H2,1-2H3,(H,15,16)(H,17,18)/t13-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	126	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of NaCT in rat hepatocytes assessed as [14C]-citrate uptake after 30 mins by scintillation counting method				J Med Chem 59: 1165-75 (2016) Article DOI: 10.1021/acs.jmedchem.5b01752 BindingDB Entry DOI: 10.7270/Q2ZW1NRC
					More data for this Ligand-Target Pair
Solute carrier family 13 member 5 (Mus musculus)	BDBM50149244 (CHEMBL3771118) Show SMILES COc1ncc(C)cc1CC[C@@](O)(CC(O)=O)C(O)=O |r| Show InChI InChI=1S/C13H17NO6/c1-8-5-9(11(20-2)14-7-8)3-4-13(19,12(17)18)6-10(15)16/h5,7,19H,3-4,6H2,1-2H3,(H,15,16)(H,17,18)/t13-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of NaCT in mouse hepatocytes assessed as [14C]-citrate uptake after 30 mins by scintillation counting method				J Med Chem 59: 1165-75 (2016) Article DOI: 10.1021/acs.jmedchem.5b01752 BindingDB Entry DOI: 10.7270/Q2ZW1NRC
					More data for this Ligand-Target Pair
Solute carrier family 13 member 5 (Mus musculus)	BDBM50149244 (CHEMBL3771118) Show SMILES COc1ncc(C)cc1CC[C@@](O)(CC(O)=O)C(O)=O |r| Show InChI InChI=1S/C13H17NO6/c1-8-5-9(11(20-2)14-7-8)3-4-13(19,12(17)18)6-10(15)16/h5,7,19H,3-4,6H2,1-2H3,(H,15,16)(H,17,18)/t13-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	214	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of NaCT in mouse hepatocytes assessed as [14C]-citrate uptake after 30 mins by scintillation counting method				J Med Chem 59: 1165-75 (2016) Article DOI: 10.1021/acs.jmedchem.5b01752 BindingDB Entry DOI: 10.7270/Q2ZW1NRC
					More data for this Ligand-Target Pair
Solute carrier family 13 member 5 (Homo sapiens (Human))	BDBM50149244 (CHEMBL3771118) Show SMILES COc1ncc(C)cc1CC[C@@](O)(CC(O)=O)C(O)=O |r| Show InChI InChI=1S/C13H17NO6/c1-8-5-9(11(20-2)14-7-8)3-4-13(19,12(17)18)6-10(15)16/h5,7,19H,3-4,6H2,1-2H3,(H,15,16)(H,17,18)/t13-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	501	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of NaCT (unknown origin) expressed in HEK293 cells assessed as inhibition of [14C]citrate uptake by microbeta plate reader analysis				J Med Chem 59: 1165-75 (2016) Article DOI: 10.1021/acs.jmedchem.5b01752 BindingDB Entry DOI: 10.7270/Q2ZW1NRC
					More data for this Ligand-Target Pair
Solute carrier family 13 member 5 (Homo sapiens (Human))	BDBM50149244 (CHEMBL3771118) Show SMILES COc1ncc(C)cc1CC[C@@](O)(CC(O)=O)C(O)=O |r| Show InChI InChI=1S/C13H17NO6/c1-8-5-9(11(20-2)14-7-8)3-4-13(19,12(17)18)6-10(15)16/h5,7,19H,3-4,6H2,1-2H3,(H,15,16)(H,17,18)/t13-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	510	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of NaCT (unknown origin) expressed in HEK293 cells assessed as inhibition of [14C]citrate uptake by microbeta plate reader analysis				J Med Chem 59: 1165-75 (2016) Article DOI: 10.1021/acs.jmedchem.5b01752 BindingDB Entry DOI: 10.7270/Q2ZW1NRC
					More data for this Ligand-Target Pair
Solute carrier family 13 member 5 (Homo sapiens (Human))	BDBM50149244 (CHEMBL3771118) Show SMILES COc1ncc(C)cc1CC[C@@](O)(CC(O)=O)C(O)=O |r| Show InChI InChI=1S/C13H17NO6/c1-8-5-9(11(20-2)14-7-8)3-4-13(19,12(17)18)6-10(15)16/h5,7,19H,3-4,6H2,1-2H3,(H,15,16)(H,17,18)/t13-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	740	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of NaCT in human hepatocytes assessed as [14C]-citrate uptake after 30 mins by scintillation counting method				J Med Chem 59: 1165-75 (2016) Article DOI: 10.1021/acs.jmedchem.5b01752 BindingDB Entry DOI: 10.7270/Q2ZW1NRC
					More data for this Ligand-Target Pair
Solute carrier family 13 member 5 (Homo sapiens (Human))	BDBM50149244 (CHEMBL3771118) Show SMILES COc1ncc(C)cc1CC[C@@](O)(CC(O)=O)C(O)=O |r| Show InChI InChI=1S/C13H17NO6/c1-8-5-9(11(20-2)14-7-8)3-4-13(19,12(17)18)6-10(15)16/h5,7,19H,3-4,6H2,1-2H3,(H,15,16)(H,17,18)/t13-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	794	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of NaCT in human hepatocytes assessed as [14C]-citrate uptake after 30 mins by scintillation counting method				J Med Chem 59: 1165-75 (2016) Article DOI: 10.1021/acs.jmedchem.5b01752 BindingDB Entry DOI: 10.7270/Q2ZW1NRC
					More data for this Ligand-Target Pair