BDBM50473276 CHEMBL302857

SMILES: Clc1ccccc1N1CCN(CCCCCCCn2nc(ccc2=O)N2CCN(CC2)C(=O)c2ccco2)CC1

InChI Key: InChIKey=LTTAECSQJNVPAI-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 = 50473276   

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))	BDBM50473276 (CHEMBL302857) Show SMILES Clc1ccccc1N1CCN(CCCCCCCn2nc(ccc2=O)N2CCN(CC2)C(=O)c2ccco2)CC1 Show InChI InChI=1S/C30H39ClN6O3/c31-25-9-4-5-10-26(25)34-18-16-33(17-19-34)14-6-2-1-3-7-15-37-29(38)13-12-28(32-37)35-20-22-36(23-21-35)30(39)27-11-8-24-40-27/h4-5,8-13,24H,1-3,6-7,14-23H2	Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	5.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Perugia Curated by ChEMBL					Assay Description Binding affinity towards alpha-1 adrenergic receptor in rat cortex membrane using [3H]-prazosin radioligand				J Med Chem 44: 2118-32 (2001) Article DOI: 10.1021/jm010821u BindingDB Entry DOI: 10.7270/Q2W3802N
					More data for this Ligand-Target Pair
Adrenergic receptor alpha-2 (RAT-NEONATAL RAT-Rattus norvegicus (rat))	BDBM50473276 (CHEMBL302857) Show SMILES Clc1ccccc1N1CCN(CCCCCCCn2nc(ccc2=O)N2CCN(CC2)C(=O)c2ccco2)CC1 Show InChI InChI=1S/C30H39ClN6O3/c31-25-9-4-5-10-26(25)34-18-16-33(17-19-34)14-6-2-1-3-7-15-37-29(38)13-12-28(32-37)35-20-22-36(23-21-35)30(39)27-11-8-24-40-27/h4-5,8-13,24H,1-3,6-7,14-23H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	24	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Perugia Curated by ChEMBL					Assay Description Binding affinity towards alpha-2 adrenergic receptor in rat cortex membrane using [3H]rauwolscine radioligand				J Med Chem 44: 2118-32 (2001) Article DOI: 10.1021/jm010821u BindingDB Entry DOI: 10.7270/Q2W3802N
					More data for this Ligand-Target Pair