BDBM50222215 CHEMBL172452

SMILES: CN1CCC2C(C1)CN1c3ccccc3CCc3cccc2c13

InChI Key: InChIKey=XDUMTLDCMGECNE-UHFFFAOYSA-N

Data: 6 IC50

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 6 hits for monomerid = 50222215   

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))	BDBM50222215 (CHEMBL172452) Show SMILES CN1CCC2C(C1)CN1c3ccccc3CCc3cccc2c13 Show InChI InChI=1S/C21H24N2/c1-22-12-11-18-17(13-22)14-23-20-8-3-2-5-15(20)9-10-16-6-4-7-19(18)21(16)23/h2-8,17-18H,9-14H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.76E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration of compound for 50% displacement of [3H]WB-4101 from Alpha-1 adrenergic receptor of rat brain				J Med Chem 23: 865-73 (1980) BindingDB Entry DOI: 10.7270/Q2542QTR
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor (RAT)	BDBM50222215 (CHEMBL172452) Show SMILES CN1CCC2C(C1)CN1c3ccccc3CCc3cccc2c13 Show InChI InChI=1S/C21H24N2/c1-22-12-11-18-17(13-22)14-23-20-8-3-2-5-15(20)9-10-16-6-4-7-19(18)21(16)23/h2-8,17-18H,9-14H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	449	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration of compound for 50% displacement of [3H]QNB from Muscarinic acetylcholine receptor in rat brain				J Med Chem 23: 865-73 (1980) BindingDB Entry DOI: 10.7270/Q2542QTR
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor (RAT)	BDBM50222215 (CHEMBL172452) Show SMILES CN1CCC2C(C1)CN1c3ccccc3CCc3cccc2c13 Show InChI InChI=1S/C21H24N2/c1-22-12-11-18-17(13-22)14-23-20-8-3-2-5-15(20)9-10-16-6-4-7-19(18)21(16)23/h2-8,17-18H,9-14H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.24E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration of compound for 50% displacement of [3H]QNB from Muscarinic acetylcholine receptor in rat brain				J Med Chem 23: 865-73 (1980) BindingDB Entry DOI: 10.7270/Q2542QTR
					More data for this Ligand-Target Pair
Dopamine receptor (Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)	BDBM50222215 (CHEMBL172452) Show SMILES CN1CCC2C(C1)CN1c3ccccc3CCc3cccc2c13 Show InChI InChI=1S/C21H24N2/c1-22-12-11-18-17(13-22)14-23-20-8-3-2-5-15(20)9-10-16-6-4-7-19(18)21(16)23/h2-8,17-18H,9-14H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	320	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration of compound for 50% displacement of [3H]spiperone from Dopamine receptor in rat brain				J Med Chem 23: 865-73 (1980) BindingDB Entry DOI: 10.7270/Q2542QTR
					More data for this Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor (Rattus norvegicus (rat)-Rattus norvegicus (Rat))	BDBM50222215 (CHEMBL172452) Show SMILES CN1CCC2C(C1)CN1c3ccccc3CCc3cccc2c13 Show InChI InChI=1S/C21H24N2/c1-22-12-11-18-17(13-22)14-23-20-8-3-2-5-15(20)9-10-16-6-4-7-19(18)21(16)23/h2-8,17-18H,9-14H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	445	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration of compound for 50% displacement of [3H]WB-4101 from Alpha-1 adrenergic receptor of rat brain				J Med Chem 23: 865-73 (1980) BindingDB Entry DOI: 10.7270/Q2542QTR
					More data for this Ligand-Target Pair
Dopamine receptor (Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)	BDBM50222215 (CHEMBL172452) Show SMILES CN1CCC2C(C1)CN1c3ccccc3CCc3cccc2c13 Show InChI InChI=1S/C21H24N2/c1-22-12-11-18-17(13-22)14-23-20-8-3-2-5-15(20)9-10-16-6-4-7-19(18)21(16)23/h2-8,17-18H,9-14H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	112	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration of compound for 50% displacement of [3H]spiperone from Dopamine receptor in rat brain				J Med Chem 23: 865-73 (1980) BindingDB Entry DOI: 10.7270/Q2542QTR
					More data for this Ligand-Target Pair