BDBM50191629 (3R)-8-fluoro-3-{[3-(5-fluoro-1H-indol-3-yl)propyl]amino}chromane-5-carboxamide::CHEMBL380401

SMILES: NC(=O)c1ccc(F)c2OC[C@@H](Cc12)NCCCc1c[nH]c2ccc(F)cc12

InChI Key: InChIKey=AWSJZZTVSOPOLT-CQSZACIVSA-N

Data: 2 KI  1 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 3 hits for monomerid = 50191629   

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 (Rattus norvegicus (rat))	BDBM50191629 ((3R)-8-fluoro-3-{[3-(5-fluoro-1H-indol-3-yl)propyl...) Show SMILES NC(=O)c1ccc(F)c2OC[C@@H](Cc12)NCCCc1c[nH]c2ccc(F)cc12 Show InChI InChI=1S/C21H21F2N3O2/c22-13-3-6-19-16(8-13)12(10-26-19)2-1-7-25-14-9-17-15(21(24)27)4-5-18(23)20(17)28-11-14/h3-6,8,10,14,25-26H,1-2,7,9,11H2,(H2,24,27)/t14-/m1/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	20.4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Displacement of [3H]paroxetine from 5-HT transporter in Sprague-Dawley rat cortical membranes				J Med Chem 49: 4785-9 (2006) Article DOI: 10.1021/jm060218h BindingDB Entry DOI: 10.7270/Q261114D
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50191629 ((3R)-8-fluoro-3-{[3-(5-fluoro-1H-indol-3-yl)propyl...) Show SMILES NC(=O)c1ccc(F)c2OC[C@@H](Cc12)NCCCc1c[nH]c2ccc(F)cc12 Show InChI InChI=1S/C21H21F2N3O2/c22-13-3-6-19-16(8-13)12(10-26-19)2-1-7-25-14-9-17-15(21(24)27)4-5-18(23)20(17)28-11-14/h3-6,8,10,14,25-26H,1-2,7,9,11H2,(H2,24,27)/t14-/m1/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	45.2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5HT1A receptor expressed in CHO cells				J Med Chem 49: 4785-9 (2006) Article DOI: 10.1021/jm060218h BindingDB Entry DOI: 10.7270/Q261114D
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50191629 ((3R)-8-fluoro-3-{[3-(5-fluoro-1H-indol-3-yl)propyl...) Show SMILES NC(=O)c1ccc(F)c2OC[C@@H](Cc12)NCCCc1c[nH]c2ccc(F)cc12 Show InChI InChI=1S/C21H21F2N3O2/c22-13-3-6-19-16(8-13)12(10-26-19)2-1-7-25-14-9-17-15(21(24)27)4-5-18(23)20(17)28-11-14/h3-6,8,10,14,25-26H,1-2,7,9,11H2,(H2,24,27)/t14-/m1/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	197	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of [3H]5-HT uptake at human 5-HT transporter expressed in Jar cells				J Med Chem 49: 4785-9 (2006) Article DOI: 10.1021/jm060218h BindingDB Entry DOI: 10.7270/Q261114D
					More data for this Ligand-Target Pair