BDBM50224806 CHEMBL355655

SMILES: O=C1COC2(CCN(CCc3c[nH]c4ccccc34)CC2)CN1

InChI Key: InChIKey=SPALXTYNFFFDEM-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 = 50224806   

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))	BDBM50224806 (CHEMBL355655) Show SMILES O=C1COC2(CCN(CCc3c[nH]c4ccccc34)CC2)CN1 Show InChI InChI=1S/C18H23N3O2/c22-17-12-23-18(13-20-17)6-9-21(10-7-18)8-5-14-11-19-16-4-2-1-3-15(14)16/h1-4,11,19H,5-10,12-13H2,(H,20,22)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	39	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Affinity for alpha-1 adrenoceptor of rat cerebral cortex was determined by ligand binding using [3H]prazosin.				J Med Chem 26: 855-61 (1983) BindingDB Entry DOI: 10.7270/Q2TH8PW6
					More data for this Ligand-Target Pair
Adrenergic receptor alpha-2 (RAT-NEONATAL RAT-Rattus norvegicus (rat))	BDBM50224806 (CHEMBL355655) Show SMILES O=C1COC2(CCN(CCc3c[nH]c4ccccc34)CC2)CN1 Show InChI InChI=1S/C18H23N3O2/c22-17-12-23-18(13-20-17)6-9-21(10-7-18)8-5-14-11-19-16-4-2-1-3-15(14)16/h1-4,11,19H,5-10,12-13H2,(H,20,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	631	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Affinity for alpha-2 adrenergic receptor of rat cerebral cortex was determined by ligand binding using [3H]yohimbine.				J Med Chem 26: 855-61 (1983) BindingDB Entry DOI: 10.7270/Q2TH8PW6
					More data for this Ligand-Target Pair