BDBM50167872 3-Chloro-4-[4-(4-pyrimidin-2-yl-3,6-dihydro-2H-pyridin-1-yl)-butyl]-4H-benzo[f][1,4]oxazepin-5-one; hydrochloride::CHEMBL558964

SMILES: ClC1=COc2ccccc2C(=O)N1CCCCN1CCC(=CC1)c1ncccn1

InChI Key: InChIKey=OGPYTXGYWMCRCN-UHFFFAOYSA-N

Data: 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 2 hits for monomerid = 50167872   

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
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM50167872 (3-Chloro-4-[4-(4-pyrimidin-2-yl-3,6-dihydro-2H-pyr...) Show SMILES ClC1=COc2ccccc2C(=O)N1CCCCN1CCC(=CC1)c1ncccn1 |c:22,t:1| Show InChI InChI=1S/C22H23ClN4O2/c23-20-16-29-19-7-2-1-6-18(19)22(28)27(20)13-4-3-12-26-14-8-17(9-15-26)21-24-10-5-11-25-21/h1-2,5-8,10-11,16H,3-4,9,12-15H2	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	494	n/a	n/a	n/a	n/a	n/a	n/a
Daiichi Suntory Biomedical Research Co., Ltd Curated by ChEMBL					Assay Description Inhibitory concentration against Dopamine receptor D2 in rat striatum membrane using [3H]raclopride as radioligand				Bioorg Med Chem Lett 15: 2990-3 (2005) Article DOI: 10.1016/j.bmcl.2005.04.059 BindingDB Entry DOI: 10.7270/Q21Z456V
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50167872 (3-Chloro-4-[4-(4-pyrimidin-2-yl-3,6-dihydro-2H-pyr...) Show SMILES ClC1=COc2ccccc2C(=O)N1CCCCN1CCC(=CC1)c1ncccn1 |c:22,t:1| Show InChI InChI=1S/C22H23ClN4O2/c23-20-16-29-19-7-2-1-6-18(19)22(28)27(20)13-4-3-12-26-14-8-17(9-15-26)21-24-10-5-11-25-21/h1-2,5-8,10-11,16H,3-4,9,12-15H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.38	n/a	n/a	n/a	n/a	n/a	n/a
Daiichi Suntory Biomedical Research Co., Ltd Curated by ChEMBL					Assay Description Inhibitory concentration against 5-hydroxytryptamine 1A receptor in rat hippocampus membrane using [3H]-8-OH-DPAT as radioligand				Bioorg Med Chem Lett 15: 2990-3 (2005) Article DOI: 10.1016/j.bmcl.2005.04.059 BindingDB Entry DOI: 10.7270/Q21Z456V
					More data for this Ligand-Target Pair