Compile Data Set for Download or QSAR

Found 19 hits Enz. Inhib. hit(s) with all data for entry = 50048473   

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 (GUINEA PIG)	BDBM50217235 (CHEMBL104827) Show SMILES Brc1ccc(CNS(=O)(=O)NCCCCc2c[nH]cn2)cc1 Show InChI InChI=1S/C14H19BrN4O2S/c15-13-6-4-12(5-7-13)9-19-22(20,21)18-8-2-1-3-14-10-16-11-17-14/h4-7,10-11,18-19H,1-3,8-9H2,(H,16,17)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The James Black Foundation Curated by ChEMBL					Assay Description Ability to displace [3H]R-alpha-methylhistamine from histamine H3 receptor in guinea pig ileum longitudinal muscle myenteric plexus(LMMP) membranes				Bioorg Med Chem Lett 9: 3103-8 (1999) BindingDB Entry DOI: 10.7270/Q2QN68ZT
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50217241 (CHEMBL104366) Show SMILES Ic1ccc(CNS(=O)(=O)NCCCCc2c[nH]cn2)cc1 Show InChI InChI=1S/C14H19IN4O2S/c15-13-6-4-12(5-7-13)9-19-22(20,21)18-8-2-1-3-14-10-16-11-17-14/h4-7,10-11,18-19H,1-3,8-9H2,(H,16,17)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The James Black Foundation Curated by ChEMBL					Assay Description Ability to displace [3H]R-alpha-methylhistamine from histamine H3 receptor in guinea pig ileum longitudinal muscle myenteric plexus(LMMP) membranes				Bioorg Med Chem Lett 9: 3103-8 (1999) BindingDB Entry DOI: 10.7270/Q2QN68ZT
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50217236 (CHEMBL105744) Show SMILES FC(F)(F)c1ccc(CNS(=O)(=O)NCCCCc2c[nH]cn2)cc1 Show InChI InChI=1S/C15H19F3N4O2S/c16-15(17,18)13-6-4-12(5-7-13)9-22-25(23,24)21-8-2-1-3-14-10-19-11-20-14/h4-7,10-11,21-22H,1-3,8-9H2,(H,19,20)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The James Black Foundation Curated by ChEMBL					Assay Description Ability to displace [3H]R-alpha-methylhistamine from histamine H3 receptor in guinea pig ileum longitudinal muscle myenteric plexus(LMMP) membranes				Bioorg Med Chem Lett 9: 3103-8 (1999) BindingDB Entry DOI: 10.7270/Q2QN68ZT
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50217238 (CHEMBL107083) Show SMILES Clc1ccc(CNS(=O)(=O)NCCCCc2c[nH]cn2)cc1 Show InChI InChI=1S/C14H19ClN4O2S/c15-13-6-4-12(5-7-13)9-19-22(20,21)18-8-2-1-3-14-10-16-11-17-14/h4-7,10-11,18-19H,1-3,8-9H2,(H,16,17)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The James Black Foundation Curated by ChEMBL					Assay Description Ability to displace [3H]R-alpha-methylhistamine from histamine H3 receptor in guinea pig ileum longitudinal muscle myenteric plexus(LMMP) membranes				Bioorg Med Chem Lett 9: 3103-8 (1999) BindingDB Entry DOI: 10.7270/Q2QN68ZT
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50217249 (CHEMBL104646) Show SMILES Clc1ccc(CS(=O)(=O)NCCCCc2c[nH]cn2)cc1 Show InChI InChI=1S/C14H18ClN3O2S/c15-13-6-4-12(5-7-13)10-21(19,20)18-8-2-1-3-14-9-16-11-17-14/h4-7,9,11,18H,1-3,8,10H2,(H,16,17)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The James Black Foundation Curated by ChEMBL					Assay Description Ability to displace [3H]R-alpha-methylhistamine from histamine H3 receptor in guinea pig ileum longitudinal muscle myenteric plexus(LMMP) membranes				Bioorg Med Chem Lett 9: 3103-8 (1999) BindingDB Entry DOI: 10.7270/Q2QN68ZT
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50217234 (CHEMBL106342) Show SMILES Clc1ccc(CNS(=O)(=O)NCCCCCCc2c[nH]cn2)cc1 Show InChI InChI=1S/C16H23ClN4O2S/c17-15-8-6-14(7-9-15)11-21-24(22,23)20-10-4-2-1-3-5-16-12-18-13-19-16/h6-9,12-13,20-21H,1-5,10-11H2,(H,18,19)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The James Black Foundation Curated by ChEMBL					Assay Description Ability to displace [3H]R-alpha-methylhistamine from histamine H3 receptor in guinea pig ileum longitudinal muscle myenteric plexus(LMMP) membranes				Bioorg Med Chem Lett 9: 3103-8 (1999) BindingDB Entry DOI: 10.7270/Q2QN68ZT
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50217237 (CHEMBL105748) Show SMILES Clc1ccc(CNS(=O)(=O)NCCCCCc2c[nH]cn2)cc1 Show InChI InChI=1S/C15H21ClN4O2S/c16-14-7-5-13(6-8-14)10-20-23(21,22)19-9-3-1-2-4-15-11-17-12-18-15/h5-8,11-12,19-20H,1-4,9-10H2,(H,17,18)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	5.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The James Black Foundation Curated by ChEMBL					Assay Description Ability to displace [3H]R-alpha-methylhistamine from histamine H3 receptor in guinea pig ileum longitudinal muscle myenteric plexus(LMMP) membranes				Bioorg Med Chem Lett 9: 3103-8 (1999) BindingDB Entry DOI: 10.7270/Q2QN68ZT
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50217242 (CHEMBL105495) Show SMILES Clc1ccc(CNS(=O)(=O)NCCCCCCCc2c[nH]cn2)cc1 Show InChI InChI=1S/C17H25ClN4O2S/c18-16-9-7-15(8-10-16)12-22-25(23,24)21-11-5-3-1-2-4-6-17-13-19-14-20-17/h7-10,13-14,21-22H,1-6,11-12H2,(H,19,20)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	7.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The James Black Foundation Curated by ChEMBL					Assay Description Ability to displace [3H]R-alpha-methylhistamine from histamine H3 receptor in guinea pig ileum longitudinal muscle myenteric plexus(LMMP) membranes				Bioorg Med Chem Lett 9: 3103-8 (1999) BindingDB Entry DOI: 10.7270/Q2QN68ZT
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50217239 (CHEMBL105161) Show SMILES O=S(=O)(NCCCCc1c[nH]cn1)NCc1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C20H24N4O2S/c25-27(26,23-13-5-4-8-20-15-21-16-22-20)24-14-17-9-11-19(12-10-17)18-6-2-1-3-7-18/h1-3,6-7,9-12,15-16,23-24H,4-5,8,13-14H2,(H,21,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	7.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The James Black Foundation Curated by ChEMBL					Assay Description Ability to displace [3H]R-alpha-methylhistamine from histamine H3 receptor in guinea pig ileum longitudinal muscle myenteric plexus(LMMP) membranes				Bioorg Med Chem Lett 9: 3103-8 (1999) BindingDB Entry DOI: 10.7270/Q2QN68ZT
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50217248 (CHEMBL322779) Show SMILES Clc1ccc(CS(=O)(=O)NCCCCCc2c[nH]cn2)cc1 Show InChI InChI=1S/C15H20ClN3O2S/c16-14-7-5-13(6-8-14)11-22(20,21)19-9-3-1-2-4-15-10-17-12-18-15/h5-8,10,12,19H,1-4,9,11H2,(H,17,18)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The James Black Foundation Curated by ChEMBL					Assay Description Ability to displace [3H]R-alpha-methylhistamine from histamine H3 receptor in guinea pig ileum longitudinal muscle myenteric plexus(LMMP) membranes				Bioorg Med Chem Lett 9: 3103-8 (1999) BindingDB Entry DOI: 10.7270/Q2QN68ZT
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50217243 (CHEMBL104522) Show SMILES Clc1ccc(CS(=O)(=O)NCCCCCCc2c[nH]cn2)cc1 Show InChI InChI=1S/C16H22ClN3O2S/c17-15-8-6-14(7-9-15)12-23(21,22)20-10-4-2-1-3-5-16-11-18-13-19-16/h6-9,11,13,20H,1-5,10,12H2,(H,18,19)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The James Black Foundation Curated by ChEMBL					Assay Description Ability to displace [3H]R-alpha-methylhistamine from histamine H3 receptor in guinea pig ileum longitudinal muscle myenteric plexus(LMMP) membranes				Bioorg Med Chem Lett 9: 3103-8 (1999) BindingDB Entry DOI: 10.7270/Q2QN68ZT
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50217240 (CHEMBL104717) Show SMILES Clc1ccc(CNS(=O)(=O)NCCCCCCCCc2c[nH]cn2)cc1 Show InChI InChI=1S/C18H27ClN4O2S/c19-17-10-8-16(9-11-17)13-23-26(24,25)22-12-6-4-2-1-3-5-7-18-14-20-15-21-18/h8-11,14-15,22-23H,1-7,12-13H2,(H,20,21)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The James Black Foundation Curated by ChEMBL					Assay Description Ability to displace [3H]R-alpha-methylhistamine from histamine H3 receptor in guinea pig ileum longitudinal muscle myenteric plexus(LMMP) membranes				Bioorg Med Chem Lett 9: 3103-8 (1999) BindingDB Entry DOI: 10.7270/Q2QN68ZT
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50217244 (CHEMBL423320) Show SMILES Fc1ccc(CNS(=O)(=O)NCCCCc2c[nH]cn2)cc1 Show InChI InChI=1S/C14H19FN4O2S/c15-13-6-4-12(5-7-13)9-19-22(20,21)18-8-2-1-3-14-10-16-11-17-14/h4-7,10-11,18-19H,1-3,8-9H2,(H,16,17)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	14	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The James Black Foundation Curated by ChEMBL					Assay Description Ability to displace [3H]R-alpha-methylhistamine from histamine H3 receptor in guinea pig ileum longitudinal muscle myenteric plexus(LMMP) membranes				Bioorg Med Chem Lett 9: 3103-8 (1999) BindingDB Entry DOI: 10.7270/Q2QN68ZT
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50217245 (CHEMBL106278) Show SMILES COc1ccc(CNS(=O)(=O)NCCCCc2c[nH]cn2)cc1 Show InChI InChI=1S/C15H22N4O3S/c1-22-15-7-5-13(6-8-15)10-19-23(20,21)18-9-3-2-4-14-11-16-12-17-14/h5-8,11-12,18-19H,2-4,9-10H2,1H3,(H,16,17)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	26	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The James Black Foundation Curated by ChEMBL					Assay Description Ability to displace [3H]R-alpha-methylhistamine from histamine H3 receptor in guinea pig ileum longitudinal muscle myenteric plexus(LMMP) membranes				Bioorg Med Chem Lett 9: 3103-8 (1999) BindingDB Entry DOI: 10.7270/Q2QN68ZT
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50217250 (CHEMBL317420) Show SMILES Clc1ccc(CS(=O)(=O)NCCCCCCCc2c[nH]cn2)cc1 Show InChI InChI=1S/C17H24ClN3O2S/c18-16-9-7-15(8-10-16)13-24(22,23)21-11-5-3-1-2-4-6-17-12-19-14-20-17/h7-10,12,14,21H,1-6,11,13H2,(H,19,20)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	36	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The James Black Foundation Curated by ChEMBL					Assay Description Ability to displace [3H]R-alpha-methylhistamine from histamine H3 receptor in guinea pig ileum longitudinal muscle myenteric plexus(LMMP) membranes				Bioorg Med Chem Lett 9: 3103-8 (1999) BindingDB Entry DOI: 10.7270/Q2QN68ZT
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50217251 (CHEMBL320432) Show SMILES Clc1ccc(CNS(=O)(=O)NCCCc2c[nH]cn2)cc1 Show InChI InChI=1S/C13H17ClN4O2S/c14-12-5-3-11(4-6-12)8-18-21(19,20)17-7-1-2-13-9-15-10-16-13/h3-6,9-10,17-18H,1-2,7-8H2,(H,15,16)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	52	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The James Black Foundation Curated by ChEMBL					Assay Description Ability to displace [3H]R-alpha-methylhistamine from histamine H3 receptor in guinea pig ileum longitudinal muscle myenteric plexus(LMMP) membranes				Bioorg Med Chem Lett 9: 3103-8 (1999) BindingDB Entry DOI: 10.7270/Q2QN68ZT
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50217247 (CHEMBL104320) Show SMILES Clc1ccc(CS(=O)(=O)NCCCCCCCCc2c[nH]cn2)cc1 Show InChI InChI=1S/C18H26ClN3O2S/c19-17-10-8-16(9-11-17)14-25(23,24)22-12-6-4-2-1-3-5-7-18-13-20-15-21-18/h8-11,13,15,22H,1-7,12,14H2,(H,20,21)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	54	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The James Black Foundation Curated by ChEMBL					Assay Description Ability to displace [3H]R-alpha-methylhistamine from histamine H3 receptor in guinea pig ileum longitudinal muscle myenteric plexus(LMMP) membranes				Bioorg Med Chem Lett 9: 3103-8 (1999) BindingDB Entry DOI: 10.7270/Q2QN68ZT
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50217233 (CHEMBL104300) Show SMILES Clc1ccc(CS(=O)(=O)NCCCCCCCCCCc2c[nH]cn2)cc1 Show InChI InChI=1S/C20H30ClN3O2S/c21-19-12-10-18(11-13-19)16-27(25,26)24-14-8-6-4-2-1-3-5-7-9-20-15-22-17-23-20/h10-13,15,17,24H,1-9,14,16H2,(H,22,23)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	59	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The James Black Foundation Curated by ChEMBL					Assay Description Ability to displace [3H]R-alpha-methylhistamine from histamine H3 receptor in guinea pig ileum longitudinal muscle myenteric plexus(LMMP) membranes				Bioorg Med Chem Lett 9: 3103-8 (1999) BindingDB Entry DOI: 10.7270/Q2QN68ZT
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50217246 (CHEMBL107073) Show SMILES Clc1ccc(CNS(=O)(=O)NCCCCCCCCCCc2c[nH]cn2)cc1 Show InChI InChI=1S/C20H31ClN4O2S/c21-19-12-10-18(11-13-19)15-25-28(26,27)24-14-8-6-4-2-1-3-5-7-9-20-16-22-17-23-20/h10-13,16-17,24-25H,1-9,14-15H2,(H,22,23)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	955	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The James Black Foundation Curated by ChEMBL					Assay Description Ability to displace [3H]R-alpha-methylhistamine from histamine H3 receptor in guinea pig ileum longitudinal muscle myenteric plexus(LMMP) membranes				Bioorg Med Chem Lett 9: 3103-8 (1999) BindingDB Entry DOI: 10.7270/Q2QN68ZT
					More data for this Ligand-Target Pair