BDBM50172091 (2S,4R)-8-Methyl-2,4-bis-(3-phenyl-propyl)-8-aza-bicyclo[3.2.1]octane::CHEMBL364264

SMILES: CN1C2CCC1[C@H](CCCc1ccccc1)C[C@@H]2CCCc1ccccc1

InChI Key: InChIKey=KRWUAJWHGJBNDT-JVOXHRMMSA-N

Data: 3 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 3 hits for monomerid = 50172091   

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
Vesicular monoamine transporter 2 (VMAT2) (Rattus norvegicus (Rat))	BDBM50172091 ((2S,4R)-8-Methyl-2,4-bis-(3-phenyl-propyl)-8-aza-b...) Show SMILES CN1C2CCC1[C@H](CCCc1ccccc1)C[C@@H]2CCCc1ccccc1 |THB:18:17:1:4.3,7:6:1:4.3| Show InChI InChI=1S/C26H35N/c1-27-25-18-19-26(27)24(17-9-15-22-12-6-3-7-13-22)20-23(25)16-8-14-21-10-4-2-5-11-21/h2-7,10-13,23-26H,8-9,14-20H2,1H3/t23-,24+,25?,26?	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.95E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Kentucky Curated by ChEMBL					Assay Description Inhibition constant against [3H]-dihydrotetrabenazine binding to vesicular monoamine transporter-2 of rat synaptic vesicle membranes				Bioorg Med Chem Lett 15: 4463-6 (2005) Article DOI: 10.1016/j.bmcl.2005.07.032 BindingDB Entry DOI: 10.7270/Q2J38S3H
					More data for this Ligand-Target Pair
Vesicular monoamine transporter 2 (VMAT2) (Rattus norvegicus (Rat))	BDBM50172091 ((2S,4R)-8-Methyl-2,4-bis-(3-phenyl-propyl)-8-aza-b...) Show SMILES CN1C2CCC1[C@H](CCCc1ccccc1)C[C@@H]2CCCc1ccccc1 |THB:18:17:1:4.3,7:6:1:4.3| Show InChI InChI=1S/C26H35N/c1-27-25-18-19-26(27)24(17-9-15-22-12-6-3-7-13-22)20-23(25)16-8-14-21-10-4-2-5-11-21/h2-7,10-13,23-26H,8-9,14-20H2,1H3/t23-,24+,25?,26?	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Kentucky Curated by ChEMBL					Assay Description Inhibition constant against [3H]-nicotine binding to vesicular monoamine transporter-2 of rat brain membranes				Bioorg Med Chem Lett 15: 4463-6 (2005) Article DOI: 10.1016/j.bmcl.2005.07.032 BindingDB Entry DOI: 10.7270/Q2J38S3H
					More data for this Ligand-Target Pair
Vesicular monoamine transporter 2 (VMAT2) (Rattus norvegicus (Rat))	BDBM50172091 ((2S,4R)-8-Methyl-2,4-bis-(3-phenyl-propyl)-8-aza-b...) Show SMILES CN1C2CCC1[C@H](CCCc1ccccc1)C[C@@H]2CCCc1ccccc1 |THB:18:17:1:4.3,7:6:1:4.3| Show InChI InChI=1S/C26H35N/c1-27-25-18-19-26(27)24(17-9-15-22-12-6-3-7-13-22)20-23(25)16-8-14-21-10-4-2-5-11-21/h2-7,10-13,23-26H,8-9,14-20H2,1H3/t23-,24+,25?,26?	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Kentucky Curated by ChEMBL					Assay Description Inhibition constant against [3H]-methyllycaconitine binding to vesicular monoamine transporter-2 of rat brain membranes				Bioorg Med Chem Lett 15: 4463-6 (2005) Article DOI: 10.1016/j.bmcl.2005.07.032 BindingDB Entry DOI: 10.7270/Q2J38S3H
					More data for this Ligand-Target Pair