null

SMILES: CCC(=O)O[C@@H]1CN(Cc2ccc(F)cc2)CC[C@H]1CCOC(c1ccccc1)c1ccccc1

InChI Key: InChIKey=HAUSKZCLZIFMCQ-RBJSKKJNSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50125900   

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
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50125900 (CHEMBL20362 | Propionic acid (3S,4S)-4-(2-benzhydr...) Show SMILES CCC(=O)O[C@@H]1CN(Cc2ccc(F)cc2)CC[C@H]1CCOC(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C30H34FNO3/c1-2-29(33)35-28-22-32(21-23-13-15-27(31)16-14-23)19-17-24(28)18-20-34-30(25-9-5-3-6-10-25)26-11-7-4-8-12-26/h3-16,24,28,30H,2,17-22H2,1H3/t24-,28+/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.78E+5	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Binding affinity towards serotonin transporter in rat striatum using [3H]citalopram as radioligand				J Med Chem 46: 1220-8 (2003) Article DOI: 10.1021/jm020275k BindingDB Entry DOI: 10.7270/Q2CZ37XT
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50125900 (CHEMBL20362 | Propionic acid (3S,4S)-4-(2-benzhydr...) Show SMILES CCC(=O)O[C@@H]1CN(Cc2ccc(F)cc2)CC[C@H]1CCOC(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C30H34FNO3/c1-2-29(33)35-28-22-32(21-23-13-15-27(31)16-14-23)19-17-24(28)18-20-34-30(25-9-5-3-6-10-25)26-11-7-4-8-12-26/h3-16,24,28,30H,2,17-22H2,1H3/t24-,28+/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	583	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Binding affinity towards dopamine transporter in rat striatum using [3H]WIN-35 428 as radioligand				J Med Chem 46: 1220-8 (2003) Article DOI: 10.1021/jm020275k BindingDB Entry DOI: 10.7270/Q2CZ37XT
					More data for this Ligand-Target Pair
Transporter (Rattus norvegicus)	BDBM50125900 (CHEMBL20362 | Propionic acid (3S,4S)-4-(2-benzhydr...) Show SMILES CCC(=O)O[C@@H]1CN(Cc2ccc(F)cc2)CC[C@H]1CCOC(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C30H34FNO3/c1-2-29(33)35-28-22-32(21-23-13-15-27(31)16-14-23)19-17-24(28)18-20-34-30(25-9-5-3-6-10-25)26-11-7-4-8-12-26/h3-16,24,28,30H,2,17-22H2,1H3/t24-,28+/m0/s1	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.58E+4	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Binding affinity towards norepinephrine transporter in rat striatum using [3H]nisoxetine as radioligand				J Med Chem 46: 1220-8 (2003) Article DOI: 10.1021/jm020275k BindingDB Entry DOI: 10.7270/Q2CZ37XT
					More data for this Ligand-Target Pair