BDBM50080567 CHEMBL121027::N-(2-Benzhydryloxy-ethyl)-N'-[2-(4-fluoro-phenyl)-ethyl]-N,N'-dimethyl-ethane-1,2-diamine

SMILES: CN(CCOC(c1ccccc1)c1ccccc1)CCN(C)CCc1ccc(F)cc1

InChI Key: InChIKey=NVIYCTHUJATAOR-UHFFFAOYSA-N

Data: 3 KI  3 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 6 hits for monomerid = 50080567   

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 (Homo sapiens (Human))	BDBM50080567 (CHEMBL121027 | N-(2-Benzhydryloxy-ethyl)-N'-[2-(4-...) Show SMILES CN(CCOC(c1ccccc1)c1ccccc1)CCN(C)CCc1ccc(F)cc1 Show InChI InChI=1S/C27H33FN2O/c1-29(18-17-23-13-15-26(28)16-14-23)19-20-30(2)21-22-31-27(24-9-5-3-6-10-24)25-11-7-4-8-12-25/h3-16,27H,17-22H2,1-2H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts General Hospital Curated by ChEMBL					Assay Description Inhibition of [125I]RTI-55 binding at Dopamine transporter (DAT) expressed in HEK cells				J Med Chem 42: 3647-56 (1999) Article DOI: 10.1021/jm990161h BindingDB Entry DOI: 10.7270/Q2BG2PPJ
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50080567 (CHEMBL121027 | N-(2-Benzhydryloxy-ethyl)-N'-[2-(4-...) Show SMILES CN(CCOC(c1ccccc1)c1ccccc1)CCN(C)CCc1ccc(F)cc1 Show InChI InChI=1S/C27H33FN2O/c1-29(18-17-23-13-15-26(28)16-14-23)19-20-30(2)21-22-31-27(24-9-5-3-6-10-24)25-11-7-4-8-12-25/h3-16,27H,17-22H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	370	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts General Hospital Curated by ChEMBL					Assay Description Inhibition of [125I]RTI-55 binding to norepinephrine transporter (NET) expressed in HEK cells				J Med Chem 42: 3647-56 (1999) Article DOI: 10.1021/jm990161h BindingDB Entry DOI: 10.7270/Q2BG2PPJ
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50080567 (CHEMBL121027 | N-(2-Benzhydryloxy-ethyl)-N'-[2-(4-...) Show SMILES CN(CCOC(c1ccccc1)c1ccccc1)CCN(C)CCc1ccc(F)cc1 Show InChI InChI=1S/C27H33FN2O/c1-29(18-17-23-13-15-26(28)16-14-23)19-20-30(2)21-22-31-27(24-9-5-3-6-10-24)25-11-7-4-8-12-25/h3-16,27H,17-22H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	550	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts General Hospital Curated by ChEMBL					Assay Description Inhibition of [125I]RTI-55 binding to serotonin transporter (SERT) expressed in HEK cells				J Med Chem 42: 3647-56 (1999) Article DOI: 10.1021/jm990161h BindingDB Entry DOI: 10.7270/Q2BG2PPJ
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50080567 (CHEMBL121027 | N-(2-Benzhydryloxy-ethyl)-N'-[2-(4-...) Show SMILES CN(CCOC(c1ccccc1)c1ccccc1)CCN(C)CCc1ccc(F)cc1 Show InChI InChI=1S/C27H33FN2O/c1-29(18-17-23-13-15-26(28)16-14-23)19-20-30(2)21-22-31-27(24-9-5-3-6-10-24)25-11-7-4-8-12-25/h3-16,27H,17-22H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	279	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts General Hospital Curated by ChEMBL					Assay Description Inhibition of [3H]- NE uptake in HEK cells expressing norepinephrine transporter				J Med Chem 42: 3647-56 (1999) Article DOI: 10.1021/jm990161h BindingDB Entry DOI: 10.7270/Q2BG2PPJ
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50080567 (CHEMBL121027 | N-(2-Benzhydryloxy-ethyl)-N'-[2-(4-...) Show SMILES CN(CCOC(c1ccccc1)c1ccccc1)CCN(C)CCc1ccc(F)cc1 Show InChI InChI=1S/C27H33FN2O/c1-29(18-17-23-13-15-26(28)16-14-23)19-20-30(2)21-22-31-27(24-9-5-3-6-10-24)25-11-7-4-8-12-25/h3-16,27H,17-22H2,1-2H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	119	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts General Hospital Curated by ChEMBL					Assay Description Inhibition of [3H]DA uptake in HEK cells expressing dopamine transporter				J Med Chem 42: 3647-56 (1999) Article DOI: 10.1021/jm990161h BindingDB Entry DOI: 10.7270/Q2BG2PPJ
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50080567 (CHEMBL121027 | N-(2-Benzhydryloxy-ethyl)-N'-[2-(4-...) Show SMILES CN(CCOC(c1ccccc1)c1ccccc1)CCN(C)CCc1ccc(F)cc1 Show InChI InChI=1S/C27H33FN2O/c1-29(18-17-23-13-15-26(28)16-14-23)19-20-30(2)21-22-31-27(24-9-5-3-6-10-24)25-11-7-4-8-12-25/h3-16,27H,17-22H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.05E+3	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts General Hospital Curated by ChEMBL					Assay Description Inhibition of [3H]- 5-HT uptake in HEK cells expressing serotonin transporter				J Med Chem 42: 3647-56 (1999) Article DOI: 10.1021/jm990161h BindingDB Entry DOI: 10.7270/Q2BG2PPJ
					More data for this Ligand-Target Pair