BDBM50301024 CHEMBL571308::N-(2-fluoroethyl)-3-isobutyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-pyrido[2,1-a]isoquinolin-2-amine

SMILES: COc1cc2CCN3CC(CC(C)C)C(CC3c2cc1OC)NCCF

InChI Key: InChIKey=YMERYCTWSIREBR-UHFFFAOYSA-N

Data: 6 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 6 hits for monomerid = 50301024   

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
Synaptic vesicular amine transporter (Rattus norvegicus (Rat))	BDBM50301024 (CHEMBL571308 | N-(2-fluoroethyl)-3-isobutyl-9,10-d...) Show SMILES COc1cc2CCN3CC(CC(C)C)C(CC3c2cc1OC)NCCF Show InChI InChI=1S/C21H33FN2O2/c1-14(2)9-16-13-24-8-5-15-10-20(25-3)21(26-4)11-17(15)19(24)12-18(16)23-7-6-22/h10-11,14,16,18-19,23H,5-9,12-13H2,1-4H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.63	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Radiopharmaceuticals (Beijing Normal University) Curated by ChEMBL					Assay Description Displacement of [3H]-DTBZ from VMAT2 in rat striatal membrane homogenates				Bioorg Med Chem Lett 19: 5026-8 (2009) Article DOI: 10.1016/j.bmcl.2009.07.048 BindingDB Entry DOI: 10.7270/Q23T9H9G
					More data for this Ligand-Target Pair
Synaptic vesicular amine transporter (Rattus norvegicus (Rat))	BDBM50301024 (CHEMBL571308 | N-(2-fluoroethyl)-3-isobutyl-9,10-d...) Show SMILES COc1cc2CCN3CC(CC(C)C)C(CC3c2cc1OC)NCCF Show InChI InChI=1S/C21H33FN2O2/c1-14(2)9-16-13-24-8-5-15-10-20(25-3)21(26-4)11-17(15)19(24)12-18(16)23-7-6-22/h10-11,14,16,18-19,23H,5-9,12-13H2,1-4H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.21	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Radiopharmaceuticals (Beijing Normal University) Curated by ChEMBL					Assay Description Displacement of [125I]-iodovinyl-TBZ from VMAT2 in rat striatal membrane homogenates				Bioorg Med Chem Lett 19: 5026-8 (2009) Article DOI: 10.1016/j.bmcl.2009.07.048 BindingDB Entry DOI: 10.7270/Q23T9H9G
					More data for this Ligand-Target Pair
Synaptic vesicular amine transporter (Rattus norvegicus (Rat))	BDBM50301024 (CHEMBL571308 | N-(2-fluoroethyl)-3-isobutyl-9,10-d...) Show SMILES COc1cc2CCN3CC(CC(C)C)C(CC3c2cc1OC)NCCF Show InChI InChI=1S/C21H33FN2O2/c1-14(2)9-16-13-24-8-5-15-10-20(25-3)21(26-4)11-17(15)19(24)12-18(16)23-7-6-22/h10-11,14,16,18-19,23H,5-9,12-13H2,1-4H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	28	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Radiopharmaceuticals (Beijing Normal University) Curated by ChEMBL					Assay Description Displacement of [125I]-iodovinyl-TBZ from VMAT2 in rat striatal membrane homogenates				Bioorg Med Chem Lett 19: 5026-8 (2009) Article DOI: 10.1016/j.bmcl.2009.07.048 BindingDB Entry DOI: 10.7270/Q23T9H9G
					More data for this Ligand-Target Pair
Synaptic vesicular amine transporter (Rattus norvegicus (Rat))	BDBM50301024 (CHEMBL571308 | N-(2-fluoroethyl)-3-isobutyl-9,10-d...) Show SMILES COc1cc2CCN3CC(CC(C)C)C(CC3c2cc1OC)NCCF Show InChI InChI=1S/C21H33FN2O2/c1-14(2)9-16-13-24-8-5-15-10-20(25-3)21(26-4)11-17(15)19(24)12-18(16)23-7-6-22/h10-11,14,16,18-19,23H,5-9,12-13H2,1-4H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	226	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Radiopharmaceuticals (Beijing Normal University) Curated by ChEMBL					Assay Description Displacement of [125I]-iodovinyl-TBZ from VMAT2 in rat striatal membrane homogenates				Bioorg Med Chem Lett 19: 5026-8 (2009) Article DOI: 10.1016/j.bmcl.2009.07.048 BindingDB Entry DOI: 10.7270/Q23T9H9G
					More data for this Ligand-Target Pair
Synaptic vesicular amine transporter (Rattus norvegicus (Rat))	BDBM50301024 (CHEMBL571308 | N-(2-fluoroethyl)-3-isobutyl-9,10-d...) Show SMILES COc1cc2CCN3CC(CC(C)C)C(CC3c2cc1OC)NCCF Show InChI InChI=1S/C21H33FN2O2/c1-14(2)9-16-13-24-8-5-15-10-20(25-3)21(26-4)11-17(15)19(24)12-18(16)23-7-6-22/h10-11,14,16,18-19,23H,5-9,12-13H2,1-4H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	230	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Radiopharmaceuticals (Beijing Normal University) Curated by ChEMBL					Assay Description Displacement of [3H]-DTBZ from VMAT2 in rat striatal membrane homogenates				Bioorg Med Chem Lett 19: 5026-8 (2009) Article DOI: 10.1016/j.bmcl.2009.07.048 BindingDB Entry DOI: 10.7270/Q23T9H9G
					More data for this Ligand-Target Pair
Synaptic vesicular amine transporter (Rattus norvegicus (Rat))	BDBM50301024 (CHEMBL571308 | N-(2-fluoroethyl)-3-isobutyl-9,10-d...) Show SMILES COc1cc2CCN3CC(CC(C)C)C(CC3c2cc1OC)NCCF Show InChI InChI=1S/C21H33FN2O2/c1-14(2)9-16-13-24-8-5-15-10-20(25-3)21(26-4)11-17(15)19(24)12-18(16)23-7-6-22/h10-11,14,16,18-19,23H,5-9,12-13H2,1-4H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	686	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Key Laboratory of Radiopharmaceuticals (Beijing Normal University) Curated by ChEMBL					Assay Description Displacement of [3H]-DTBZ from VMAT2 in rat striatal membrane homogenates				Bioorg Med Chem Lett 19: 5026-8 (2009) Article DOI: 10.1016/j.bmcl.2009.07.048 BindingDB Entry DOI: 10.7270/Q23T9H9G
					More data for this Ligand-Target Pair