BDBM50474061 CHEMBL41061

SMILES: C(CN1CCN(C\C=C\c2ccccc2)CC1)N(Cc1ccccc1)c1ccccc1

InChI Key: InChIKey=PQUSJGFLYJZNNR-XNTDXEJSSA-N

Data: 2 Kd

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 = 50474061   

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 (Homo sapiens (Human))	BDBM50474061 (CHEMBL41061) Show SMILES C(CN1CCN(C\C=C\c2ccccc2)CC1)N(Cc1ccccc1)c1ccccc1 Show InChI InChI=1S/C28H33N3/c1-4-11-26(12-5-1)15-10-18-29-19-21-30(22-20-29)23-24-31(28-16-8-3-9-17-28)25-27-13-6-2-7-14-27/h1-17H,18-25H2/b15-10+	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	603	n/a	n/a	n/a	n/a	n/a
Universit£ di Perugia Curated by ChEMBL					Assay Description Inhibition of [125I]RTI-55 binding to human SERT in clonal cells				J Med Chem 45: 1577-84 (2002) Article DOI: 10.1021/jm011007+ BindingDB Entry DOI: 10.7270/Q29026JT
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50474061 (CHEMBL41061) Show SMILES C(CN1CCN(C\C=C\c2ccccc2)CC1)N(Cc1ccccc1)c1ccccc1 Show InChI InChI=1S/C28H33N3/c1-4-11-26(12-5-1)15-10-18-29-19-21-30(22-20-29)23-24-31(28-16-8-3-9-17-28)25-27-13-6-2-7-14-27/h1-17H,18-25H2/b15-10+	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	447	n/a	n/a	n/a	n/a	n/a
Universit£ di Perugia Curated by ChEMBL					Assay Description Inhibition of radioligand [125I]RTI-55 binding to human Dopamine transporter in clonal cells				J Med Chem 45: 1577-84 (2002) Article DOI: 10.1021/jm011007+ BindingDB Entry DOI: 10.7270/Q29026JT
					More data for this Ligand-Target Pair