BDBM50304266 (S)-2-(1-(4,4-diphenylbut-3-enyl)pyrrolidin-2-yl)acetic acid::CHEMBL594213

SMILES: [#8]-[#6](=O)-[#6]-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6]-[#6]\[#6]=[#6](\c1ccccc1)-c1ccccc1

InChI Key: InChIKey=ZSHXWEIQLMBKTH-FQEVSTJZSA-N

Data: 2 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 2 hits for monomerid = 50304266   

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
GABA transporter (Mus musculus)	BDBM50304266 ((S)-2-(1-(4,4-diphenylbut-3-enyl)pyrrolidin-2-yl)a...) Show SMILES [#8]-[#6](=O)-[#6]-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6]-[#6]\[#6]=[#6](\c1ccccc1)-c1ccccc1 |r| Show InChI InChI=1S/C22H25NO2/c24-22(25)17-20-13-7-15-23(20)16-8-14-21(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-6,9-12,14,20H,7-8,13,15-17H2,(H,24,25)/t20-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.48E+4	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Microbiology Curated by ChEMBL					Assay Description Inhibition of GAT3 in mouse D8 cells assessed as [3H]GABA transport by liquid scintillation counting				Bioorg Med Chem 17: 6540-6 (2009) Article DOI: 10.1016/j.bmc.2009.08.010 BindingDB Entry DOI: 10.7270/Q26110DK
					More data for this Ligand-Target Pair
GABA transporter (Mus musculus)	BDBM50304266 ((S)-2-(1-(4,4-diphenylbut-3-enyl)pyrrolidin-2-yl)a...) Show SMILES [#8]-[#6](=O)-[#6]-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6]-[#6]\[#6]=[#6](\c1ccccc1)-c1ccccc1 |r| Show InChI InChI=1S/C22H25NO2/c24-22(25)17-20-13-7-15-23(20)16-8-14-21(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-6,9-12,14,20H,7-8,13,15-17H2,(H,24,25)/t20-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Microbiology Curated by ChEMBL					Assay Description Inhibition of GAT1 in mouse D8 cells assessed as [3H]GABA transport by liquid scintillation counting				Bioorg Med Chem 17: 6540-6 (2009) Article DOI: 10.1016/j.bmc.2009.08.010 BindingDB Entry DOI: 10.7270/Q26110DK
					More data for this Ligand-Target Pair