Compile Data Set for Download or QSAR

Found 16 hits with Last Name = 'vincze' and Initial = 'k'   

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
Histamine H3 receptor (Homo sapiens (Human))	BDBM50520922 (CHEMBL4547780) Show SMILES CC(=O)c1ccc(OCCCN2CCN(CC2)c2ccncc2)cc1 Show InChI InChI=1S/C20H25N3O2/c1-17(24)18-3-5-20(6-4-18)25-16-2-11-22-12-14-23(15-13-22)19-7-9-21-10-8-19/h3-10H,2,11-16H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to at human H3 receptor				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127522 BindingDB Entry DOI: 10.7270/Q29K4FVC
					More data for this Ligand-Target Pair
Histamine H3 receptor (Homo sapiens (Human))	BDBM50520924 (CHEMBL4581913) Show SMILES CC(=O)c1ccc(OCCCN2CCN(CC2)c2ccccn2)cc1 Show InChI InChI=1S/C20H25N3O2/c1-17(24)18-6-8-19(9-7-18)25-16-4-11-22-12-14-23(15-13-22)20-5-2-3-10-21-20/h2-3,5-10H,4,11-16H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	315	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to at human H3 receptor				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127522 BindingDB Entry DOI: 10.7270/Q29K4FVC
					More data for this Ligand-Target Pair
Histamine H3 receptor (Homo sapiens (Human))	BDBM50405909 (CHEMBL4170784) Show SMILES CCC(C)(C)c1ccc(OCCCCN2CCN(CC2)c2cnccn2)cc1 Show InChI InChI=1S/C23H32O3S/c24-23(25)13-7-2-1-6-12-19-20(22-15-14-21(19)26-22)17-27-16-8-11-18-9-4-3-5-10-18/h1,3-6,9-10,19-22H,2,7-8,11-17H2,(H,24,25)/b6-1-	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	683	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to at human H3 receptor				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127522 BindingDB Entry DOI: 10.7270/Q29K4FVC
					More data for this Ligand-Target Pair
Histamine H3 receptor (Homo sapiens (Human))	BDBM50405708 (CHEMBL4166945) Show SMILES CC(C)(C)c1ccc(OCCCCN2CCN(CC2)c2ncccn2)cc1 Show InChI InChI=1S/C15H19NO3S/c1-10(9-20)14(17)16-8-12(7-13(16)15(18)19)11-5-3-2-4-6-11/h2-6,10,12-13,20H,7-9H2,1H3,(H,18,19)/t10-,12+,13+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	883	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to at human H3 receptor				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127522 BindingDB Entry DOI: 10.7270/Q29K4FVC
					More data for this Ligand-Target Pair
Histamine H3 receptor (Homo sapiens (Human))	BDBM50520935 (CHEMBL4473431) Show SMILES CC(=O)c1ccc(OCCCCN2CCN(CC2)c2cccnc2)cc1 Show InChI InChI=1S/C21H27N3O2/c1-18(25)19-6-8-21(9-7-19)26-16-3-2-11-23-12-14-24(15-13-23)20-5-4-10-22-17-20/h4-10,17H,2-3,11-16H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	908	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to at human H3 receptor				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127522 BindingDB Entry DOI: 10.7270/Q29K4FVC
					More data for this Ligand-Target Pair
Histamine H3 receptor (Homo sapiens (Human))	BDBM50520933 (CHEMBL4467220) Show SMILES CC(=O)c1ccc(OCCCCN2CCN(CC2)c2ncccn2)cc1 Show InChI InChI=1S/C20H26N4O2/c1-17(25)18-5-7-19(8-6-18)26-16-3-2-11-23-12-14-24(15-13-23)20-21-9-4-10-22-20/h4-10H,2-3,11-16H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.23E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to at human H3 receptor				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127522 BindingDB Entry DOI: 10.7270/Q29K4FVC
					More data for this Ligand-Target Pair
Histamine H3 receptor (Homo sapiens (Human))	BDBM50520937 (CHEMBL4445569) Show SMILES CCC(=O)c1ccc(OCCCN2CCN(CC2)c2cnccn2)cc1 Show InChI InChI=1S/C20H26N4O2/c1-2-19(25)17-4-6-18(7-5-17)26-15-3-10-23-11-13-24(14-12-23)20-16-21-8-9-22-20/h4-9,16H,2-3,10-15H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.72E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to at human H3 receptor				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127522 BindingDB Entry DOI: 10.7270/Q29K4FVC
					More data for this Ligand-Target Pair
Histamine H3 receptor (Homo sapiens (Human))	BDBM50405908 (CHEMBL4162840) Show SMILES CCC(C)(C)c1ccc(OCCCCN2CCN(CC2)c2ncccn2)cc1 Show InChI InChI=1S/C18H30O3S/c1-2-3-12-22-13-15-14(16-10-11-17(15)21-16)8-6-4-5-7-9-18(19)20/h4,6,14-17H,2-3,5,7-13H2,1H3,(H,19,20)/b6-4-	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	2.26E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to at human H3 receptor				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127522 BindingDB Entry DOI: 10.7270/Q29K4FVC
					More data for this Ligand-Target Pair
Histamine H3 receptor (Homo sapiens (Human))	BDBM50520941 (CHEMBL4519189) Show SMILES CC(=O)c1ccc(OCCCN2CCN(CC2)c2ncccn2)cc1 Show InChI InChI=1S/C19H24N4O2/c1-16(24)17-4-6-18(7-5-17)25-15-3-10-22-11-13-23(14-12-22)19-20-8-2-9-21-19/h2,4-9H,3,10-15H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.32E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to at human H3 receptor				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127522 BindingDB Entry DOI: 10.7270/Q29K4FVC
					More data for this Ligand-Target Pair
Histamine H3 receptor (Homo sapiens (Human))	BDBM50405707 (CHEMBL4163913) Show SMILES CC(C)(C)c1ccc(OCCCCN2CCN(CC2)c2ccccn2)cc1 Show InChI InChI=1S/C15H19NO4S/c1-10(9-21)14(17)16-8-12(7-13(16)15(18)19)20-11-5-3-2-4-6-11/h2-6,10,12-13,21H,7-9H2,1H3,(H,18,19)/t10-,12+,13+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	2.96E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to at human H3 receptor				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127522 BindingDB Entry DOI: 10.7270/Q29K4FVC
					More data for this Ligand-Target Pair
Histamine H3 receptor (Homo sapiens (Human))	BDBM50520934 (CHEMBL4453108) Show SMILES CCC(=O)c1ccc(OCCCN2CCN(CC2)c2ncccn2)cc1 Show InChI InChI=1S/C20H26N4O2/c1-2-19(25)17-5-7-18(8-6-17)26-16-4-11-23-12-14-24(15-13-23)20-21-9-3-10-22-20/h3,5-10H,2,4,11-16H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	3.39E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to at human H3 receptor				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127522 BindingDB Entry DOI: 10.7270/Q29K4FVC
					More data for this Ligand-Target Pair
Histamine H3 receptor (Homo sapiens (Human))	BDBM50405734 (CHEMBL4170350) Show SMILES CC(C)(C)c1ccc(OCCCCN2CCN(CC2)c2cccnc2)cc1 Show InChI InChI=1S/C17H30N7O3S/c1-28(10(4-6-19)3-2-5-18)7-11-13(25)14(26)17(27-11)24-9-23-12-15(20)21-8-22-16(12)24/h8-11,13-14,17,25-26H,2-7,18-19H2,1H3,(H2,20,21,22)/q+1/t10?,11-,13?,14?,17?,28?/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	3.42E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to at human H3 receptor				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127522 BindingDB Entry DOI: 10.7270/Q29K4FVC
					More data for this Ligand-Target Pair
Histamine H3 receptor (Homo sapiens (Human))	BDBM50520940 (CHEMBL4452580) Show SMILES CC(=O)c1ccc(OCCCCN2CCN(CC2)c2ccccn2)cc1 Show InChI InChI=1S/C21H27N3O2/c1-18(25)19-7-9-20(10-8-19)26-17-5-4-12-23-13-15-24(16-14-23)21-6-2-3-11-22-21/h2-3,6-11H,4-5,12-17H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	3.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to at human H3 receptor				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127522 BindingDB Entry DOI: 10.7270/Q29K4FVC
					More data for this Ligand-Target Pair
Histamine H3 receptor (Homo sapiens (Human))	BDBM50405712 (CHEMBL4166262) Show SMILES CC(C)(C)c1ccc(OCCCN2CCN(CC2)c2ncccn2)cc1 Show InChI InChI=1S/C9H13NO4S/c1-5(4-15)8(12)10-3-6(11)2-7(10)9(13)14/h5,7,15H,2-4H2,1H3,(H,13,14)/t5-,7+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	3.83E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to at human H3 receptor				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127522 BindingDB Entry DOI: 10.7270/Q29K4FVC
					More data for this Ligand-Target Pair
Histamine H3 receptor (Homo sapiens (Human))	BDBM50405702 (CHEMBL4159046) Show SMILES CC(C)(C)c1ccc(OCCCCN2CCN(CC2)c2cnccn2)cc1 Show InChI InChI=1S/C15H18FNO3S2/c1-9(8-21)14(18)17-7-12(6-13(17)15(19)20)22-11-4-2-10(16)3-5-11/h2-5,9,12-13,21H,6-8H2,1H3,(H,19,20)/t9-,12+,13+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	5.48E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to at human H3 receptor				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127522 BindingDB Entry DOI: 10.7270/Q29K4FVC
					More data for this Ligand-Target Pair
Histamine H3 receptor (Homo sapiens (Human))	BDBM50405703 (CHEMBL4171151) Show SMILES CCC(C)(C)c1ccc(OCCCCN2CCN(CC2)c2cccnc2)cc1 Show InChI InChI=1S/C19H26N2O5S/c1-12(17(22)21-11-14(27-2)10-16(21)19(25)26)20-15(18(23)24)9-8-13-6-4-3-5-7-13/h3-7,12,14-16,20H,8-11H2,1-2H3,(H,23,24)(H,25,26)/t12-,14+,15-,16-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to at human H3 receptor				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127522 BindingDB Entry DOI: 10.7270/Q29K4FVC
					More data for this Ligand-Target Pair