BDBM50473258 CHEMBL417565

SMILES: Clc1ccccc1N1CCN(CCCCCn2nc(ccc2=O)N2CCN(CC2)C(=O)c2ccco2)CC1

InChI Key: InChIKey=OBOGYKVWLPQVDO-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 = 50473258   

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-1A/Alpha-1B/Alpha-1D adrenergic receptor (Rattus norvegicus (rat)-Rattus norvegicus (Rat))	BDBM50473258 (CHEMBL417565) Show SMILES Clc1ccccc1N1CCN(CCCCCn2nc(ccc2=O)N2CCN(CC2)C(=O)c2ccco2)CC1 Show InChI InChI=1S/C28H35ClN6O3/c29-23-7-2-3-8-24(23)32-16-14-31(15-17-32)12-4-1-5-13-35-27(36)11-10-26(30-35)33-18-20-34(21-19-33)28(37)25-9-6-22-38-25/h2-3,6-11,22H,1,4-5,12-21H2	Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	13	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
Alpha-2A adrenergic receptor [16-465]/Alpha-2B adrenergic receptor/Alpha-2C adrenergic receptor (RAT-NEONATAL RAT-Rattus norvegicus (rat))	BDBM50473258 (CHEMBL417565) Show SMILES Clc1ccccc1N1CCN(CCCCCn2nc(ccc2=O)N2CCN(CC2)C(=O)c2ccco2)CC1 Show InChI InChI=1S/C28H35ClN6O3/c29-23-7-2-3-8-24(23)32-16-14-31(15-17-32)12-4-1-5-13-35-27(36)11-10-26(30-35)33-18-20-34(21-19-33)28(37)25-9-6-22-38-25/h2-3,6-11,22H,1,4-5,12-21H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	105	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