BDBM50070101 CHEMBL3407840

SMILES: Cl.C1CN=C(Nc2ccc3CCCCc3n2)N1

InChI Key: InChIKey=MDMPKBVNLDREMU-UHFFFAOYSA-N

Data: 1 KI  1 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 2 hits for monomerid = 50070101   

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
Adrenergic receptor alpha-2 (Homo sapiens (Human))	BDBM50070101 (CHEMBL3407840) Show SMILES Cl.C1CN=C(Nc2ccc3CCCCc3n2)N1 |t:2| Show InChI InChI=1S/C12H16N4/c1-2-4-10-9(3-1)5-6-11(15-10)16-12-13-7-8-14-12/h5-6H,1-4,7-8H2,(H2,13,14,15,16)	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	537	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of [3H]-RX-821002 from human alpha-2 adrenergic receptor in brain prefrontal cortex membrane by liquid scintillation spectrometry				J Med Chem 58: 963-77 (2015) Article DOI: 10.1021/jm501635e BindingDB Entry DOI: 10.7270/Q280549P
					More data for this Ligand-Target Pair
Adrenergic receptor alpha-2 (Homo sapiens (Human))	BDBM50070101 (CHEMBL3407840) Show SMILES Cl.C1CN=C(Nc2ccc3CCCCc3n2)N1 |t:2| Show InChI InChI=1S/C12H16N4/c1-2-4-10-9(3-1)5-6-11(15-10)16-12-13-7-8-14-12/h5-6H,1-4,7-8H2,(H2,13,14,15,16)	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	3.57E+3	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Antagonist activity at human alpha-2 adrenergic receptor in brain prefrontal cortex membrane assessed as inhibition of UK14304-induced [35S]-GTPgamma...				J Med Chem 58: 963-77 (2015) Article DOI: 10.1021/jm501635e BindingDB Entry DOI: 10.7270/Q280549P
					More data for this Ligand-Target Pair