BDBM50024568 CHEMBL3330622

SMILES: COc1ccccc1N1CCN(CCCCCn2ncc(=O)n(C)c2=O)CC1

InChI Key: InChIKey=YEJKTKYCAOZNLH-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50024568   

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))	BDBM50024568 (CHEMBL3330622) Show SMILES COc1ccccc1N1CCN(CCCCCn2ncc(=O)n(C)c2=O)CC1 Show InChI InChI=1S/C20H29N5O3/c1-22-19(26)16-21-25(20(22)27)11-7-3-6-10-23-12-14-24(15-13-23)17-8-4-5-9-18(17)28-2/h4-5,8-9,16H,3,6-7,10-15H2,1-2H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	150	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Stony Brook University Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from 5HT1AR (unknown origin) by competition binding assay				Bioorg Med Chem Lett 24: 4759-62 (2014) Article DOI: 10.1016/j.bmcl.2014.07.048 BindingDB Entry DOI: 10.7270/Q2NZ896M
					More data for this Ligand-Target Pair