BDBM50246288 3-phenyl-2-(4-(3-(piperidin-1-yl)propoxy)phenyl)quinazolin-4(3H)-one::CHEMBL487060

SMILES: O=c1n(-c2ccccc2)c(nc2ccccc12)-c1ccc(OCCCN2CCCCC2)cc1

InChI Key: InChIKey=MDGOMXLQCXHZJE-UHFFFAOYSA-N

Data: 1 KI  4 IC50

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 = 50246288   

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
Histamine H3 receptor (Homo sapiens (Human))	BDBM50246288 (3-phenyl-2-(4-(3-(piperidin-1-yl)propoxy)phenyl)qu...) Show SMILES O=c1n(-c2ccccc2)c(nc2ccccc12)-c1ccc(OCCCN2CCCCC2)cc1 Show InChI InChI=1S/C28H29N3O2/c32-28-25-12-5-6-13-26(25)29-27(31(28)23-10-3-1-4-11-23)22-14-16-24(17-15-22)33-21-9-20-30-18-7-2-8-19-30/h1,3-6,10-17H,2,7-9,18-21H2	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bioprojet-Biotech Curated by ChEMBL					Assay Description Displacement of [125I]Iodoproxyfan from human recombinant histamine H3 receptor by Competitive binding assay				Bioorg Med Chem Lett 21: 5378-83 (2011) Article DOI: 10.1016/j.bmcl.2011.07.006 BindingDB Entry DOI: 10.7270/Q2VX0GXK
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50246288 (3-phenyl-2-(4-(3-(piperidin-1-yl)propoxy)phenyl)qu...) Show SMILES O=c1n(-c2ccccc2)c(nc2ccccc12)-c1ccc(OCCCN2CCCCC2)cc1 Show InChI InChI=1S/C28H29N3O2/c32-28-25-12-5-6-13-26(25)29-27(31(28)23-10-3-1-4-11-23)22-14-16-24(17-15-22)33-21-9-20-30-18-7-2-8-19-30/h1,3-6,10-17H,2,7-9,18-21H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	460	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Displacement of [35S]MK499 from human ERG expressed in HEK293 cells				Bioorg Med Chem Lett 18: 6041-5 (2008) Article DOI: 10.1016/j.bmcl.2008.10.034 BindingDB Entry DOI: 10.7270/Q2QJ7H5R
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50246288 (3-phenyl-2-(4-(3-(piperidin-1-yl)propoxy)phenyl)qu...) Show SMILES O=c1n(-c2ccccc2)c(nc2ccccc12)-c1ccc(OCCCN2CCCCC2)cc1 Show InChI InChI=1S/C28H29N3O2/c32-28-25-12-5-6-13-26(25)29-27(31(28)23-10-3-1-4-11-23)22-14-16-24(17-15-22)33-21-9-20-30-18-7-2-8-19-30/h1,3-6,10-17H,2,7-9,18-21H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	460	n/a	n/a	n/a	n/a	n/a	n/a
Bioprojet-Biotech Curated by ChEMBL					Assay Description Displacement of [3H]dofetilide from human recombinant ERG by Competitive binding assay				Bioorg Med Chem Lett 21: 5378-83 (2011) Article DOI: 10.1016/j.bmcl.2011.07.006 BindingDB Entry DOI: 10.7270/Q2VX0GXK
					More data for this Ligand-Target Pair
Histamine H3 receptor (Homo sapiens (Human))	BDBM50246288 (3-phenyl-2-(4-(3-(piperidin-1-yl)propoxy)phenyl)qu...) Show SMILES O=c1n(-c2ccccc2)c(nc2ccccc12)-c1ccc(OCCCN2CCCCC2)cc1 Show InChI InChI=1S/C28H29N3O2/c32-28-25-12-5-6-13-26(25)29-27(31(28)23-10-3-1-4-11-23)22-14-16-24(17-15-22)33-21-9-20-30-18-7-2-8-19-30/h1,3-6,10-17H,2,7-9,18-21H2	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.60	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Inverse agonist activity at human histamine H3 receptor assessed as inhibition of R-alpha-methylhistamine-induced [35S]GTPgammaS binding				Bioorg Med Chem Lett 18: 6041-5 (2008) Article DOI: 10.1016/j.bmcl.2008.10.034 BindingDB Entry DOI: 10.7270/Q2QJ7H5R
					More data for this Ligand-Target Pair
Alpha-1A adrenergic receptor (Homo sapiens (Human))	BDBM50246288 (3-phenyl-2-(4-(3-(piperidin-1-yl)propoxy)phenyl)qu...) Show SMILES O=c1n(-c2ccccc2)c(nc2ccccc12)-c1ccc(OCCCN2CCCCC2)cc1 Show InChI InChI=1S/C28H29N3O2/c32-28-25-12-5-6-13-26(25)29-27(31(28)23-10-3-1-4-11-23)22-14-16-24(17-15-22)33-21-9-20-30-18-7-2-8-19-30/h1,3-6,10-17H,2,7-9,18-21H2	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Displacement of [3H]prazosin from human adrenergic alpha1A receptor expressed in LMtk- cells				Bioorg Med Chem Lett 18: 6041-5 (2008) Article DOI: 10.1016/j.bmcl.2008.10.034 BindingDB Entry DOI: 10.7270/Q2QJ7H5R
					More data for this Ligand-Target Pair