BDBM50213582 7-[3-(4-phenylpiperazin-1-yl)-propyl]-1,3-dimethyl-7,9-dihydro-3H-purine-2,6,8-trione::CHEMBL228938

SMILES: Cn1c2[nH]c(=O)n(CCCN3CCN(CC3)c3ccccc3)c2c(=O)n(C)c1=O

InChI Key: InChIKey=NGMZQZCRQLEVTJ-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 = 50213582   

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 2A (Rattus norvegicus (rat))	BDBM50213582 (7-[3-(4-phenylpiperazin-1-yl)-propyl]-1,3-dimethyl...) Show SMILES Cn1c2[nH]c(=O)n(CCCN3CCN(CC3)c3ccccc3)c2c(=O)n(C)c1=O Show InChI InChI=1S/C20H26N6O3/c1-22-17-16(18(27)23(2)20(22)29)26(19(28)21-17)10-6-9-24-11-13-25(14-12-24)15-7-4-3-5-8-15/h3-5,7-8H,6,9-14H2,1-2H3,(H,21,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	230	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]ketanserin from rat brain 5HT2A receptor				Bioorg Med Chem 15: 5239-50 (2007) Article DOI: 10.1016/j.bmc.2007.05.017 BindingDB Entry DOI: 10.7270/Q22F7P87
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50213582 (7-[3-(4-phenylpiperazin-1-yl)-propyl]-1,3-dimethyl...) Show SMILES Cn1c2[nH]c(=O)n(CCCN3CCN(CC3)c3ccccc3)c2c(=O)n(C)c1=O Show InChI InChI=1S/C20H26N6O3/c1-22-17-16(18(27)23(2)20(22)29)26(19(28)21-17)10-6-9-24-11-13-25(14-12-24)15-7-4-3-5-8-15/h3-5,7-8H,6,9-14H2,1-2H3,(H,21,28)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.21E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from rat brain 5HT1A receptor				Bioorg Med Chem 15: 5239-50 (2007) Article DOI: 10.1016/j.bmc.2007.05.017 BindingDB Entry DOI: 10.7270/Q22F7P87
					More data for this Ligand-Target Pair
Serotonin (5-HT) receptor (Rattus norvegicus (rat))	BDBM50213582 (7-[3-(4-phenylpiperazin-1-yl)-propyl]-1,3-dimethyl...) Show SMILES Cn1c2[nH]c(=O)n(CCCN3CCN(CC3)c3ccccc3)c2c(=O)n(C)c1=O Show InChI InChI=1S/C20H26N6O3/c1-22-17-16(18(27)23(2)20(22)29)26(19(28)21-17)10-6-9-24-11-13-25(14-12-24)15-7-4-3-5-8-15/h3-5,7-8H,6,9-14H2,1-2H3,(H,21,28)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.39E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]5CT from 5HT7 receptor in Wistar rat hypothalamic membrane				Bioorg Med Chem 15: 5239-50 (2007) Article DOI: 10.1016/j.bmc.2007.05.017 BindingDB Entry DOI: 10.7270/Q22F7P87
					More data for this Ligand-Target Pair