BDBM50474053 CHEMBL415886

SMILES: Fc1ccc(cc1)C(OCCN1CCN(CC1)C(=O)\C=C\c1ccc(Cl)cc1)c1ccc(F)cc1

InChI Key: InChIKey=ZBPXHTCVLBTEET-LZWSPWQCSA-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 = 50474053   

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))	BDBM50474053 (CHEMBL415886) Show SMILES Fc1ccc(cc1)C(OCCN1CCN(CC1)C(=O)\C=C\c1ccc(Cl)cc1)c1ccc(F)cc1 Show InChI InChI=1S/C28H27ClF2N2O2/c29-24-8-1-21(2-9-24)3-14-27(34)33-17-15-32(16-18-33)19-20-35-28(22-4-10-25(30)11-5-22)23-6-12-26(31)13-7-23/h1-14,28H,15-20H2/b14-3+	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	72	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))	BDBM50474053 (CHEMBL415886) Show SMILES Fc1ccc(cc1)C(OCCN1CCN(CC1)C(=O)\C=C\c1ccc(Cl)cc1)c1ccc(F)cc1 Show InChI InChI=1S/C28H27ClF2N2O2/c29-24-8-1-21(2-9-24)3-14-27(34)33-17-15-32(16-18-33)19-20-35-28(22-4-10-25(30)11-5-22)23-6-12-26(31)13-7-23/h1-14,28H,15-20H2/b14-3+	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	427	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