BDBM50378729 CHEMBL1204043

SMILES: Nc1cccc2C[C@H]([C@H](O)Cc12)N1CCC(CC1)C(=O)c1ccc(F)cc1

InChI Key: InChIKey=FWDSPKZKADMGQL-NHCUHLMSSA-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 = 50378729   

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 acetylcholine transporter (Torpedo californica)	BDBM50378729 (CHEMBL1204043) Show SMILES Nc1cccc2C[C@H]([C@H](O)Cc12)N1CCC(CC1)C(=O)c1ccc(F)cc1 |r| Show InChI InChI=1S/C22H25FN2O2/c23-17-6-4-14(5-7-17)22(27)15-8-10-25(11-9-15)20-12-16-2-1-3-19(24)18(16)13-21(20)26/h1-7,15,20-21,26H,8-13,24H2/t20-,21-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Minnesota Curated by ChEMBL					Assay Description Displacement of [3H]vesamicol from VAChT in Torpedo californica cholinergic synaptic vesicles				J Med Chem 53: 2825-35 (2010) Article DOI: 10.1021/jm9017916 BindingDB Entry DOI: 10.7270/Q2542PJR
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50378729 (CHEMBL1204043) Show SMILES Nc1cccc2C[C@H]([C@H](O)Cc12)N1CCC(CC1)C(=O)c1ccc(F)cc1 |r| Show InChI InChI=1S/C22H25FN2O2/c23-17-6-4-14(5-7-17)22(27)15-8-10-25(11-9-15)20-12-16-2-1-3-19(24)18(16)13-21(20)26/h1-7,15,20-21,26H,8-13,24H2/t20-,21-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	497	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Minnesota Curated by ChEMBL					Assay Description Displacement of [3H](+)-pentazocine from sigma 1 receptor in guinea pig brain membrane homogenates after 90 mins by liquid scintillation counting				J Med Chem 53: 2825-35 (2010) Article DOI: 10.1021/jm9017916 BindingDB Entry DOI: 10.7270/Q2542PJR
					More data for this Ligand-Target Pair