BDBM50191635 CHEMBL209784::rac-8-fluoro-3-[[4-(5-fluoro-1H-indol-3-yl)butyl](propyl)amino] chromane-5-carboxamide

SMILES: CCCN(CCCCc1c[nH]c2ccc(F)cc12)C1COc2c(F)ccc(C(N)=O)c2C1

InChI Key: InChIKey=AWTICCZHEMZKBF-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 = 50191635   

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))	BDBM50191635 (CHEMBL209784 | rac-8-fluoro-3-[[4-(5-fluoro-1H-ind...) Show SMILES CCCN(CCCCc1c[nH]c2ccc(F)cc12)C1COc2c(F)ccc(C(N)=O)c2C1 Show InChI InChI=1S/C25H29F2N3O2/c1-2-10-30(11-4-3-5-16-14-29-23-9-6-17(26)12-20(16)23)18-13-21-19(25(28)31)7-8-22(27)24(21)32-15-18/h6-9,12,14,18,29H,2-5,10-11,13,15H2,1H3,(H2,28,31)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.40	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))	BDBM50191635 (CHEMBL209784 | rac-8-fluoro-3-[[4-(5-fluoro-1H-ind...) Show SMILES CCCN(CCCCc1c[nH]c2ccc(F)cc12)C1COc2c(F)ccc(C(N)=O)c2C1 Show InChI InChI=1S/C25H29F2N3O2/c1-2-10-30(11-4-3-5-16-14-29-23-9-6-17(26)12-20(16)23)18-13-21-19(25(28)31)7-8-22(27)24(21)32-15-18/h6-9,12,14,18,29H,2-5,10-11,13,15H2,1H3,(H2,28,31)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	12.2	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))	BDBM50191635 (CHEMBL209784 | rac-8-fluoro-3-[[4-(5-fluoro-1H-ind...) Show SMILES CCCN(CCCCc1c[nH]c2ccc(F)cc12)C1COc2c(F)ccc(C(N)=O)c2C1 Show InChI InChI=1S/C25H29F2N3O2/c1-2-10-30(11-4-3-5-16-14-29-23-9-6-17(26)12-20(16)23)18-13-21-19(25(28)31)7-8-22(27)24(21)32-15-18/h6-9,12,14,18,29H,2-5,10-11,13,15H2,1H3,(H2,28,31)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	217	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))	BDBM50191635 (CHEMBL209784 | rac-8-fluoro-3-[[4-(5-fluoro-1H-ind...) Show SMILES CCCN(CCCCc1c[nH]c2ccc(F)cc12)C1COc2c(F)ccc(C(N)=O)c2C1 Show InChI InChI=1S/C25H29F2N3O2/c1-2-10-30(11-4-3-5-16-14-29-23-9-6-17(26)12-20(16)23)18-13-21-19(25(28)31)7-8-22(27)24(21)32-15-18/h6-9,12,14,18,29H,2-5,10-11,13,15H2,1H3,(H2,28,31)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	125	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