BDBM50483138 CHEMBL1632414

SMILES: CN1CCC(CC1)C(=N\O)\c1nc2cc(Cl)ccc2[nH]1

InChI Key: InChIKey=ZKDRIYJOVIMHFC-AQTBWJFISA-N

Data: 6 KI  3 EC50

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 9 hits for monomerid = 50483138   

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 H4 Receptor (Mus musculus (mouse))	BDBM50483138 (CHEMBL1632414) Show SMILES CN1CCC(CC1)C(=N\O)\c1nc2cc(Cl)ccc2[nH]1 Show InChI InChI=1S/C14H17ClN4O/c1-19-6-4-9(5-7-19)13(18-20)14-16-11-3-2-10(15)8-12(11)17-14/h2-3,8-9,20H,4-7H2,1H3,(H,16,17)/b18-13-	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	7.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Regensburg Curated by ChEMBL					Assay Description Binding affinity to mouse histamine H4 receptor expressed in human SK-N-MC cells by radioligand displacement assay				Bioorg Med Chem Lett 20: 7191-9 (2010) Article DOI: 10.1016/j.bmcl.2010.10.041 BindingDB Entry DOI: 10.7270/Q2Q81GX5
					More data for this Ligand-Target Pair
Histamine H4 Receptor (Rattus norvegicus (rat))	BDBM50483138 (CHEMBL1632414) Show SMILES CN1CCC(CC1)C(=N\O)\c1nc2cc(Cl)ccc2[nH]1 Show InChI InChI=1S/C14H17ClN4O/c1-19-6-4-9(5-7-19)13(18-20)14-16-11-3-2-10(15)8-12(11)17-14/h2-3,8-9,20H,4-7H2,1H3,(H,16,17)/b18-13-	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Regensburg Curated by ChEMBL					Assay Description Binding affinity to rat histamine H4 receptor expressed in human SK-N-MC cells by radioligand displacement assay				Bioorg Med Chem Lett 20: 7191-9 (2010) Article DOI: 10.1016/j.bmcl.2010.10.041 BindingDB Entry DOI: 10.7270/Q2Q81GX5
					More data for this Ligand-Target Pair
Histamine receptor (H3 and H4) (Homo sapiens (Human))	BDBM50483138 (CHEMBL1632414) Show SMILES CN1CCC(CC1)C(=N\O)\c1nc2cc(Cl)ccc2[nH]1 Show InChI InChI=1S/C14H17ClN4O/c1-19-6-4-9(5-7-19)13(18-20)14-16-11-3-2-10(15)8-12(11)17-14/h2-3,8-9,20H,4-7H2,1H3,(H,16,17)/b18-13-	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Regensburg Curated by ChEMBL					Assay Description Binding affinity to human recombinant histamine H4 receptor expressed in human SK-N-MC cells by radioligand displacement assay				Bioorg Med Chem Lett 20: 7191-9 (2010) Article DOI: 10.1016/j.bmcl.2010.10.041 BindingDB Entry DOI: 10.7270/Q2Q81GX5
					More data for this Ligand-Target Pair
Histamine H2 receptor (Homo sapiens (Human))	BDBM50483138 (CHEMBL1632414) Show SMILES CN1CCC(CC1)C(=N\O)\c1nc2cc(Cl)ccc2[nH]1 Show InChI InChI=1S/C14H17ClN4O/c1-19-6-4-9(5-7-19)13(18-20)14-16-11-3-2-10(15)8-12(11)17-14/h2-3,8-9,20H,4-7H2,1H3,(H,16,17)/b18-13-	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	<1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Regensburg Curated by ChEMBL					Assay Description Binding affinity to human recombinant histamine H2 receptor expressed in human SK-N-MC cells by radioligand displacement assay				Bioorg Med Chem Lett 20: 7191-9 (2010) Article DOI: 10.1016/j.bmcl.2010.10.041 BindingDB Entry DOI: 10.7270/Q2Q81GX5
					More data for this Ligand-Target Pair
Histamine H1 receptor (Homo sapiens (Human))	BDBM50483138 (CHEMBL1632414) Show SMILES CN1CCC(CC1)C(=N\O)\c1nc2cc(Cl)ccc2[nH]1 Show InChI InChI=1S/C14H17ClN4O/c1-19-6-4-9(5-7-19)13(18-20)14-16-11-3-2-10(15)8-12(11)17-14/h2-3,8-9,20H,4-7H2,1H3,(H,16,17)/b18-13-	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	<1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Regensburg Curated by ChEMBL					Assay Description Binding affinity to human recombinant histamine H1 receptor expressed in human SK-N-MC cells by radioligand displacement assay				Bioorg Med Chem Lett 20: 7191-9 (2010) Article DOI: 10.1016/j.bmcl.2010.10.041 BindingDB Entry DOI: 10.7270/Q2Q81GX5
					More data for this Ligand-Target Pair
Histamine H3 receptor (Homo sapiens (Human))	BDBM50483138 (CHEMBL1632414) Show SMILES CN1CCC(CC1)C(=N\O)\c1nc2cc(Cl)ccc2[nH]1 Show InChI InChI=1S/C14H17ClN4O/c1-19-6-4-9(5-7-19)13(18-20)14-16-11-3-2-10(15)8-12(11)17-14/h2-3,8-9,20H,4-7H2,1H3,(H,16,17)/b18-13-	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	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 Regensburg Curated by ChEMBL					Assay Description Binding affinity to human recombinant histamine H3 receptor expressed in human SK-N-MC cells by radioligand displacement assay				Bioorg Med Chem Lett 20: 7191-9 (2010) Article DOI: 10.1016/j.bmcl.2010.10.041 BindingDB Entry DOI: 10.7270/Q2Q81GX5
					More data for this Ligand-Target Pair
Histamine receptor (H3 and H4) (Homo sapiens (Human))	BDBM50483138 (CHEMBL1632414) Show SMILES CN1CCC(CC1)C(=N\O)\c1nc2cc(Cl)ccc2[nH]1 Show InChI InChI=1S/C14H17ClN4O/c1-19-6-4-9(5-7-19)13(18-20)14-16-11-3-2-10(15)8-12(11)17-14/h2-3,8-9,20H,4-7H2,1H3,(H,16,17)/b18-13-	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	79	n/a	n/a	n/a	n/a
University of Regensburg Curated by ChEMBL					Assay Description Agonist activity at human recombinant histamine H4 receptor expressed in human SK-N-MC cells co-expressing SRE-Luc by luciferase reporter gene assay				Bioorg Med Chem Lett 20: 7191-9 (2010) Article DOI: 10.1016/j.bmcl.2010.10.041 BindingDB Entry DOI: 10.7270/Q2Q81GX5
					More data for this Ligand-Target Pair
Histamine H4 Receptor (Mus musculus (mouse))	BDBM50483138 (CHEMBL1632414) Show SMILES CN1CCC(CC1)C(=N\O)\c1nc2cc(Cl)ccc2[nH]1 Show InChI InChI=1S/C14H17ClN4O/c1-19-6-4-9(5-7-19)13(18-20)14-16-11-3-2-10(15)8-12(11)17-14/h2-3,8-9,20H,4-7H2,1H3,(H,16,17)/b18-13-	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	63	n/a	n/a	n/a	n/a
University of Regensburg Curated by ChEMBL					Assay Description Agonist activity at mouse histamine H4 receptor by luciferase reporter gene assay				Bioorg Med Chem Lett 20: 7191-9 (2010) Article DOI: 10.1016/j.bmcl.2010.10.041 BindingDB Entry DOI: 10.7270/Q2Q81GX5
					More data for this Ligand-Target Pair
Histamine H4 Receptor (Rattus norvegicus (rat))	BDBM50483138 (CHEMBL1632414) Show SMILES CN1CCC(CC1)C(=N\O)\c1nc2cc(Cl)ccc2[nH]1 Show InChI InChI=1S/C14H17ClN4O/c1-19-6-4-9(5-7-19)13(18-20)14-16-11-3-2-10(15)8-12(11)17-14/h2-3,8-9,20H,4-7H2,1H3,(H,16,17)/b18-13-	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	200	n/a	n/a	n/a	n/a
University of Regensburg Curated by ChEMBL					Assay Description Agonist activity at rat histamine H4 receptor by luciferase reporter gene assay				Bioorg Med Chem Lett 20: 7191-9 (2010) Article DOI: 10.1016/j.bmcl.2010.10.041 BindingDB Entry DOI: 10.7270/Q2Q81GX5
					More data for this Ligand-Target Pair