BDBM50191634 CHEMBL210348::rac-3-{ethyl[2-(5-fluoro-1H-indol-3-yl)ethyl]amino}-8-fluorochromane-5-carboxamide

SMILES: CCN(CCc1c[nH]c2ccc(F)cc12)C1COc2c(F)ccc(C(N)=O)c2C1

InChI Key: InChIKey=FNHDODLEOOYUHU-UHFFFAOYSA-N

Data: 2 KI  2 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 4 hits for monomerid = 50191634   

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
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50191634 (CHEMBL210348 | rac-3-{ethyl[2-(5-fluoro-1H-indol-3...) Show SMILES CCN(CCc1c[nH]c2ccc(F)cc12)C1COc2c(F)ccc(C(N)=O)c2C1 Show InChI InChI=1S/C22H23F2N3O2/c1-2-27(8-7-13-11-26-20-6-3-14(23)9-17(13)20)15-10-18-16(22(25)28)4-5-19(24)21(18)29-12-15/h3-6,9,11,15,26H,2,7-8,10,12H2,1H3,(H2,25,28)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	33.2	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 (Rattus norvegicus (rat))	BDBM50191634 (CHEMBL210348 | rac-3-{ethyl[2-(5-fluoro-1H-indol-3...) Show SMILES CCN(CCc1c[nH]c2ccc(F)cc12)C1COc2c(F)ccc(C(N)=O)c2C1 Show InChI InChI=1S/C22H23F2N3O2/c1-2-27(8-7-13-11-26-20-6-3-14(23)9-17(13)20)15-10-18-16(22(25)28)4-5-19(24)21(18)29-12-15/h3-6,9,11,15,26H,2,7-8,10,12H2,1H3,(H2,25,28)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	60.2	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]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
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50191634 (CHEMBL210348 | rac-3-{ethyl[2-(5-fluoro-1H-indol-3...) Show SMILES CCN(CCc1c[nH]c2ccc(F)cc12)C1COc2c(F)ccc(C(N)=O)c2C1 Show InChI InChI=1S/C22H23F2N3O2/c1-2-27(8-7-13-11-26-20-6-3-14(23)9-17(13)20)15-10-18-16(22(25)28)4-5-19(24)21(18)29-12-15/h3-6,9,11,15,26H,2,7-8,10,12H2,1H3,(H2,25,28)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	883	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
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50191634 (CHEMBL210348 | rac-3-{ethyl[2-(5-fluoro-1H-indol-3...) Show SMILES CCN(CCc1c[nH]c2ccc(F)cc12)C1COc2c(F)ccc(C(N)=O)c2C1 Show InChI InChI=1S/C22H23F2N3O2/c1-2-27(8-7-13-11-26-20-6-3-14(23)9-17(13)20)15-10-18-16(22(25)28)4-5-19(24)21(18)29-12-15/h3-6,9,11,15,26H,2,7-8,10,12H2,1H3,(H2,25,28)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	68	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Agonist activity at human 5HT1A receptor expressed in CHO cells by inhibition of 8-OH-DPAT-induced decrease in forskolin-stimulated cAMP production				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