BDBM50489329 CHEMBL2311756

SMILES: Cl.COc1ccccc1N1CCN(CCCOc2cccc3c2oc2cc(Cl)ccc2c3=O)CC1

InChI Key: InChIKey=CAESXNNVFIKIAV-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50489329   

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
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor (Rattus norvegicus (rat)-Rattus norvegicus (Rat))	BDBM50489329 (CHEMBL2311756) Show SMILES Cl.COc1ccccc1N1CCN(CCCOc2cccc3c2oc2cc(Cl)ccc2c3=O)CC1 Show InChI InChI=1S/C27H27ClN2O4/c1-32-23-8-3-2-7-22(23)30-15-13-29(14-16-30)12-5-17-33-24-9-4-6-21-26(31)20-11-10-19(28)18-25(20)34-27(21)24/h2-4,6-11,18H,5,12-17H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	82	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]-prazosin from alpha1-adrenergic receptor in rat cerebral cortex by liquid scintillation counting				Bioorg Med Chem 21: 514-22 (2013) Article DOI: 10.1016/j.bmc.2012.11.014 BindingDB Entry DOI: 10.7270/Q2P27200
					More data for this Ligand-Target Pair
Adrenergic receptor alpha-2 (RAT-NEONATAL RAT-Rattus norvegicus (rat))	BDBM50489329 (CHEMBL2311756) Show SMILES Cl.COc1ccccc1N1CCN(CCCOc2cccc3c2oc2cc(Cl)ccc2c3=O)CC1 Show InChI InChI=1S/C27H27ClN2O4/c1-32-23-8-3-2-7-22(23)30-15-13-29(14-16-30)12-5-17-33-24-9-4-6-21-26(31)20-11-10-19(28)18-25(20)34-27(21)24/h2-4,6-11,18H,5,12-17H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	5.50E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]clonidine from alpha2-adrenergic receptor in rat cerebral cortex by liquid scintillation counting				Bioorg Med Chem 21: 514-22 (2013) Article DOI: 10.1016/j.bmc.2012.11.014 BindingDB Entry DOI: 10.7270/Q2P27200
					More data for this Ligand-Target Pair