BDBM50162708 3-(5-fluoro-1H-indol-3-yl)-N,N-dimethylpropan-1-amine::CHEMBL361949::[3-(5-Fluoro-1H-indol-3-yl)-propyl]-dimethyl-amine

SMILES: CN(C)CCCc1c[nH]c2ccc(F)cc12

InChI Key: InChIKey=UFBLPBWRPPLNJN-UHFFFAOYSA-N

Data: 1 KI  4 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 5 hits for monomerid = 50162708   

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))	BDBM50162708 (3-(5-fluoro-1H-indol-3-yl)-N,N-dimethylpropan-1-am...) Show SMILES CN(C)CCCc1c[nH]c2ccc(F)cc12 Show InChI InChI=1S/C13H17FN2/c1-16(2)7-3-4-10-9-15-13-6-5-11(14)8-12(10)13/h5-6,8-9,15H,3-4,7H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Binding inhibition towards human serotonin transporter				J Med Chem 48: 6023-34 (2005) Article DOI: 10.1021/jm0503291 BindingDB Entry DOI: 10.7270/Q2PN96DN
					More data for this Ligand-Target Pair
Myeloperoxidase (MPO) (Homo sapiens (Human))	BDBM50162708 (3-(5-fluoro-1H-indol-3-yl)-N,N-dimethylpropan-1-am...) Show SMILES CN(C)CCCc1c[nH]c2ccc(F)cc12 Show InChI InChI=1S/C13H17FN2/c1-16(2)7-3-4-10-9-15-13-6-5-11(14)8-12(10)13/h5-6,8-9,15H,3-4,7H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	49	n/a	n/a	n/a	n/a	n/a	n/a
Universite£? Libre de Bruxelles Curated by ChEMBL					Assay Description Inhibition of recombinant MPO mediated LDL oxidation using MPO/Cl-/H2O2 system				J Med Chem 53: 8747-59 (2010) Article DOI: 10.1021/jm1009988 BindingDB Entry DOI: 10.7270/Q24T6JNJ
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50162708 (3-(5-fluoro-1H-indol-3-yl)-N,N-dimethylpropan-1-am...) Show SMILES CN(C)CCCc1c[nH]c2ccc(F)cc12 Show InChI InChI=1S/C13H17FN2/c1-16(2)7-3-4-10-9-15-13-6-5-11(14)8-12(10)13/h5-6,8-9,15H,3-4,7H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibitory concentration against serotonin transporter protein (SERT) expressed in HEK293 cells				Bioorg Med Chem Lett 15: 1619-21 (2005) Article DOI: 10.1016/j.bmcl.2005.01.059 BindingDB Entry DOI: 10.7270/Q25140FV
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50162708 (3-(5-fluoro-1H-indol-3-yl)-N,N-dimethylpropan-1-am...) Show SMILES CN(C)CCCc1c[nH]c2ccc(F)cc12 Show InChI InChI=1S/C13H17FN2/c1-16(2)7-3-4-10-9-15-13-6-5-11(14)8-12(10)13/h5-6,8-9,15H,3-4,7H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibition of human SERT				Bioorg Med Chem Lett 17: 5647-51 (2007) Article DOI: 10.1016/j.bmcl.2007.07.083 BindingDB Entry DOI: 10.7270/Q2KP82Z6
					More data for this Ligand-Target Pair
Myeloperoxidase (MPO) (Homo sapiens (Human))	BDBM50162708 (3-(5-fluoro-1H-indol-3-yl)-N,N-dimethylpropan-1-am...) Show SMILES CN(C)CCCc1c[nH]c2ccc(F)cc12 Show InChI InChI=1S/C13H17FN2/c1-16(2)7-3-4-10-9-15-13-6-5-11(14)8-12(10)13/h5-6,8-9,15H,3-4,7H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
Universite£? Libre de Bruxelles Curated by ChEMBL					Assay Description Inhibition of recombinant MPO mediated taurine chlorination by microplate reader method				J Med Chem 53: 8747-59 (2010) Article DOI: 10.1021/jm1009988 BindingDB Entry DOI: 10.7270/Q24T6JNJ
					More data for this Ligand-Target Pair