BDBM50445615 CHEMBL3104092

SMILES: CN1CCc2c(C1)c1cccc3Cc4ccccc4Cn2c13

InChI Key: InChIKey=RQBRUGMHSQYCNU-UHFFFAOYSA-N

Data: 6 KI

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 6 hits for monomerid = 50445615   

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 H1 receptor (Homo sapiens (Human))	BDBM50445615 (CHEMBL3104092) Show SMILES CN1CCc2c(C1)c1cccc3Cc4ccccc4Cn2c13 Show InChI InChI=1S/C20H20N2/c1-21-10-9-19-18(13-21)17-8-4-7-15-11-14-5-2-3-6-16(14)12-22(19)20(15)17/h2-8H,9-13H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	48	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Missouri Curated by ChEMBL					Assay Description Displacement of [3H]Pyrilamine from histamine H1 receptor (unknown origin)				Bioorg Med Chem Lett 24: 576-9 (2014) Article DOI: 10.1016/j.bmcl.2013.12.024 BindingDB Entry DOI: 10.7270/Q2MS3V7R
					More data for this Ligand-Target Pair
Histamine H1 receptor (Homo sapiens (Human))	BDBM50445615 (CHEMBL3104092) Show SMILES CN1CCc2c(C1)c1cccc3Cc4ccccc4Cn2c13 Show InChI InChI=1S/C20H20N2/c1-21-10-9-19-18(13-21)17-8-4-7-15-11-14-5-2-3-6-16(14)12-22(19)20(15)17/h2-8H,9-13H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	48	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Missouri Curated by ChEMBL					Assay Description Displacement of [3H]Pyrilamine from histamine H1 receptor (unknown origin)				Bioorg Med Chem Lett 24: 576-9 (2014) Article DOI: 10.1016/j.bmcl.2013.12.024 BindingDB Entry DOI: 10.7270/Q2MS3V7R
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A (Homo sapiens (Human))	BDBM50445615 (CHEMBL3104092) Show SMILES CN1CCc2c(C1)c1cccc3Cc4ccccc4Cn2c13 Show InChI InChI=1S/C20H20N2/c1-21-10-9-19-18(13-21)17-8-4-7-15-11-14-5-2-3-6-16(14)12-22(19)20(15)17/h2-8H,9-13H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Missouri Curated by ChEMBL					Assay Description Displacement of [3H]GR65630 from 5-HT3 receptor (unknown origin)				Bioorg Med Chem Lett 24: 576-9 (2014) Article DOI: 10.1016/j.bmcl.2013.12.024 BindingDB Entry DOI: 10.7270/Q2MS3V7R
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50445615 (CHEMBL3104092) Show SMILES CN1CCc2c(C1)c1cccc3Cc4ccccc4Cn2c13 Show InChI InChI=1S/C20H20N2/c1-21-10-9-19-18(13-21)17-8-4-7-15-11-14-5-2-3-6-16(14)12-22(19)20(15)17/h2-8H,9-13H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Missouri Curated by ChEMBL					Assay Description Displacement of [3H]N-Methylspiperone from dopamine D2 receptor (unknown origin)				Bioorg Med Chem Lett 24: 576-9 (2014) Article DOI: 10.1016/j.bmcl.2013.12.024 BindingDB Entry DOI: 10.7270/Q2MS3V7R
					More data for this Ligand-Target Pair
Histamine H2 Receptor (Homo sapiens (Human))	BDBM50445615 (CHEMBL3104092) Show SMILES CN1CCc2c(C1)c1cccc3Cc4ccccc4Cn2c13 Show InChI InChI=1S/C20H20N2/c1-21-10-9-19-18(13-21)17-8-4-7-15-11-14-5-2-3-6-16(14)12-22(19)20(15)17/h2-8H,9-13H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Missouri Curated by ChEMBL					Assay Description Displacement of [3H]Cimetidine from histamine H2 receptor (unknown origin)				Bioorg Med Chem Lett 24: 576-9 (2014) Article DOI: 10.1016/j.bmcl.2013.12.024 BindingDB Entry DOI: 10.7270/Q2MS3V7R
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Homo sapiens (Human))	BDBM50445615 (CHEMBL3104092) Show SMILES CN1CCc2c(C1)c1cccc3Cc4ccccc4Cn2c13 Show InChI InChI=1S/C20H20N2/c1-21-10-9-19-18(13-21)17-8-4-7-15-11-14-5-2-3-6-16(14)12-22(19)20(15)17/h2-8H,9-13H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Missouri Curated by ChEMBL					Assay Description Displacement of [3H](+)Pentazocine from sigma 1 receptor (unknown origin)				Bioorg Med Chem Lett 24: 576-9 (2014) Article DOI: 10.1016/j.bmcl.2013.12.024 BindingDB Entry DOI: 10.7270/Q2MS3V7R
					More data for this Ligand-Target Pair