BDBM50349953 CHEMBL1812285

SMILES: COc1cccc(c1)N1CCN(CCCCn2cnc3c4ccccc4ncc3c2=O)CC1

InChI Key: InChIKey=KTECFZCYIARBRU-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50349953   

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 (Rattus norvegicus (rat))	BDBM50349953 (CHEMBL1812285) Show SMILES COc1cccc(c1)N1CCN(CCCCn2cnc3c4ccccc4ncc3c2=O)CC1 Show InChI InChI=1S/C26H29N5O2/c1-33-21-8-6-7-20(17-21)30-15-13-29(14-16-30)11-4-5-12-31-19-28-25-22-9-2-3-10-24(22)27-18-23(25)26(31)32/h2-3,6-10,17-19H,4-5,11-16H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	31	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Lodz Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from 5HT1A receptor in rat hippocampal membrane by radioligand binding assay				Eur J Med Chem 46: 3348-61 (2011) Article DOI: 10.1016/j.ejmech.2011.04.060 BindingDB Entry DOI: 10.7270/Q21836VH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 7 (Homo sapiens (Human))	BDBM50349953 (CHEMBL1812285) Show SMILES COc1cccc(c1)N1CCN(CCCCn2cnc3c4ccccc4ncc3c2=O)CC1 Show InChI InChI=1S/C26H29N5O2/c1-33-21-8-6-7-20(17-21)30-15-13-29(14-16-30)11-4-5-12-31-19-28-25-22-9-2-3-10-24(22)27-18-23(25)26(31)32/h2-3,6-10,17-19H,4-5,11-16H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	484	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Lodz Curated by ChEMBL					Assay Description Displacement of [3H]-5-CT from human 5-HT7b receptor expressed in HEK293 cells by radioligand binding assay				Eur J Med Chem 46: 3348-61 (2011) Article DOI: 10.1016/j.ejmech.2011.04.060 BindingDB Entry DOI: 10.7270/Q21836VH
					More data for this Ligand-Target Pair