BDBM50049092 2-[5-(7-Methyl-octyloxy)-1H-indol-3-yl]-ethylamine::CHEMBL111283

SMILES: CC(C)CCCCCCOc1ccc2[nH]cc(CCN)c2c1

InChI Key: InChIKey=LGZWLUXHZSSNTO-UHFFFAOYSA-N

Data: 3 KI

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 = 50049092   

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 1B (Homo sapiens (Human))	BDBM50049092 (2-[5-(7-Methyl-octyloxy)-1H-indol-3-yl]-ethylamine...) Show SMILES CC(C)CCCCCCOc1ccc2[nH]cc(CCN)c2c1 Show InChI InChI=1S/C19H30N2O/c1-15(2)7-5-3-4-6-12-22-17-8-9-19-18(13-17)16(10-11-20)14-21-19/h8-9,13-15,21H,3-7,10-12,20H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	14	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Virginia Commonwealth University Curated by ChEMBL					Assay Description Binding affinity for recombinant human 5-hydroxytryptamine 1D receptor beta was determined using [3H]-5-HT as radioligand				J Med Chem 39: 314-22 (1996) Article DOI: 10.1021/jm950498t BindingDB Entry DOI: 10.7270/Q2DJ5DRK
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1D (Homo sapiens (Human))	BDBM50049092 (2-[5-(7-Methyl-octyloxy)-1H-indol-3-yl]-ethylamine...) Show SMILES CC(C)CCCCCCOc1ccc2[nH]cc(CCN)c2c1 Show InChI InChI=1S/C19H30N2O/c1-15(2)7-5-3-4-6-12-22-17-8-9-19-18(13-17)16(10-11-20)14-21-19/h8-9,13-15,21H,3-7,10-12,20H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	42	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Virginia Commonwealth University Curated by ChEMBL					Assay Description In vitro affitnity human cloned 5-hydroxytryptamine 1D receptor alpha by [3H]-5-HT displacement.				J Med Chem 39: 314-22 (1996) Article DOI: 10.1021/jm950498t BindingDB Entry DOI: 10.7270/Q2DJ5DRK
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50049092 (2-[5-(7-Methyl-octyloxy)-1H-indol-3-yl]-ethylamine...) Show SMILES CC(C)CCCCCCOc1ccc2[nH]cc(CCN)c2c1 Show InChI InChI=1S/C19H30N2O/c1-15(2)7-5-3-4-6-12-22-17-8-9-19-18(13-17)16(10-11-20)14-21-19/h8-9,13-15,21H,3-7,10-12,20H2,1-2H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1.18E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Virginia Commonwealth University Curated by ChEMBL					Assay Description In vitro affinity at human cloned 5-hydroxytryptamine 1A receptor by [3H]-8-OH-DPAT displacement.				J Med Chem 39: 314-22 (1996) Article DOI: 10.1021/jm950498t BindingDB Entry DOI: 10.7270/Q2DJ5DRK
					More data for this Ligand-Target Pair