BDBM50375465 CHEMBL258725::D-254C

SMILES: O[C@@H](CN[C@H]1CC[C@H](NC1)C(c1ccccc1)c1ccccc1)Cc1ccccc1

InChI Key: InChIKey=YKFRXVGLZNKBAS-NXCFDTQHSA-N

Data: 4 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 4 hits for monomerid = 50375465   

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 dopamine transporter (Rattus norvegicus (rat))	BDBM50375465 (CHEMBL258725 | D-254C) Show SMILES O[C@@H](CN[C@H]1CC[C@H](NC1)C(c1ccccc1)c1ccccc1)Cc1ccccc1 Show InChI InChI=1S/C27H32N2O/c30-25(18-21-10-4-1-5-11-21)20-28-24-16-17-26(29-19-24)27(22-12-6-2-7-13-22)23-14-8-3-9-15-23/h1-15,24-30H,16-20H2/t24-,25+,26-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	10.6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Inhibition of [3H]dopamine uptake in DAT in rat striatum				Bioorg Med Chem 16: 2769-78 (2008) Article DOI: 10.1016/j.bmc.2008.01.009 BindingDB Entry DOI: 10.7270/Q2PR7WWG
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50375465 (CHEMBL258725 | D-254C) Show SMILES O[C@@H](CN[C@H]1CC[C@H](NC1)C(c1ccccc1)c1ccccc1)Cc1ccccc1 Show InChI InChI=1S/C27H32N2O/c30-25(18-21-10-4-1-5-11-21)20-28-24-16-17-26(29-19-24)27(22-12-6-2-7-13-22)23-14-8-3-9-15-23/h1-15,24-30H,16-20H2/t24-,25+,26-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	25.1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Displacement of [3H]WIN-from DAT in rat striatum				Bioorg Med Chem 16: 2769-78 (2008) Article DOI: 10.1016/j.bmc.2008.01.009 BindingDB Entry DOI: 10.7270/Q2PR7WWG
					More data for this Ligand-Target Pair
Norepinephrine Monoamine transporters (Rattus norvegicus)	BDBM50375465 (CHEMBL258725 | D-254C) Show SMILES O[C@@H](CN[C@H]1CC[C@H](NC1)C(c1ccccc1)c1ccccc1)Cc1ccccc1 Show InChI InChI=1S/C27H32N2O/c30-25(18-21-10-4-1-5-11-21)20-28-24-16-17-26(29-19-24)27(22-12-6-2-7-13-22)23-14-8-3-9-15-23/h1-15,24-30H,16-20H2/t24-,25+,26-/m0/s1	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	170	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Inhibition of [3H]NE uptake in NET in rat cerebral cortex				Bioorg Med Chem 16: 2769-78 (2008) Article DOI: 10.1016/j.bmc.2008.01.009 BindingDB Entry DOI: 10.7270/Q2PR7WWG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50375465 (CHEMBL258725 | D-254C) Show SMILES O[C@@H](CN[C@H]1CC[C@H](NC1)C(c1ccccc1)c1ccccc1)Cc1ccccc1 Show InChI InChI=1S/C27H32N2O/c30-25(18-21-10-4-1-5-11-21)20-28-24-16-17-26(29-19-24)27(22-12-6-2-7-13-22)23-14-8-3-9-15-23/h1-15,24-30H,16-20H2/t24-,25+,26-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.39E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Inhibition of [3H]5HT uptake in SERT in rat cerebral cortex				Bioorg Med Chem 16: 2769-78 (2008) Article DOI: 10.1016/j.bmc.2008.01.009 BindingDB Entry DOI: 10.7270/Q2PR7WWG
					More data for this Ligand-Target Pair