BDBM50029319 1-{2-[4-(2-Isopropoxy-phenyl)-piperazin-1-ylmethyl]-benzyl}-piperidin-2-one::CHEMBL10105

SMILES: CC(C)Oc1ccccc1N1CCN(Cc2ccccc2CN2CCCCC2=O)CC1

InChI Key: InChIKey=BKOZXYDJNCUNBD-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50029319   

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))	BDBM50029319 (1-{2-[4-(2-Isopropoxy-phenyl)-piperazin-1-ylmethyl...) Show SMILES CC(C)Oc1ccccc1N1CCN(Cc2ccccc2CN2CCCCC2=O)CC1 Show InChI InChI=1S/C26H35N3O2/c1-21(2)31-25-12-6-5-11-24(25)28-17-15-27(16-18-28)19-22-9-3-4-10-23(22)20-29-14-8-7-13-26(29)30/h3-6,9-12,21H,7-8,13-20H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	1.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
R. W. Johnson Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Binding affinity towards 5-hydroxytryptamine 1A receptor of rat brain synaptosomal preparations				J Med Chem 37: 1060-2 (1994) BindingDB Entry DOI: 10.7270/Q23R0RXB
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50029319 (1-{2-[4-(2-Isopropoxy-phenyl)-piperazin-1-ylmethyl...) Show SMILES CC(C)Oc1ccccc1N1CCN(Cc2ccccc2CN2CCCCC2=O)CC1 Show InChI InChI=1S/C26H35N3O2/c1-21(2)31-25-12-6-5-11-24(25)28-17-15-27(16-18-28)19-22-9-3-4-10-23(22)20-29-14-8-7-13-26(29)30/h3-6,9-12,21H,7-8,13-20H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	1.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
R.W. Johnson Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Affinity against the 5-hydroxytryptamine receptor 1A using [3H]WB-4101.				J Med Chem 38: 4211-22 (1995) BindingDB Entry DOI: 10.7270/Q2C53MH2
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM50029319 (1-{2-[4-(2-Isopropoxy-phenyl)-piperazin-1-ylmethyl...) Show SMILES CC(C)Oc1ccccc1N1CCN(Cc2ccccc2CN2CCCCC2=O)CC1 Show InChI InChI=1S/C26H35N3O2/c1-21(2)31-25-12-6-5-11-24(25)28-17-15-27(16-18-28)19-22-9-3-4-10-23(22)20-29-14-8-7-13-26(29)30/h3-6,9-12,21H,7-8,13-20H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	46	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
R.W. Johnson Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Affinity against the dopamine receptor D2 using [3H]spiperinone.				J Med Chem 38: 4211-22 (1995) BindingDB Entry DOI: 10.7270/Q2C53MH2
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM50029319 (1-{2-[4-(2-Isopropoxy-phenyl)-piperazin-1-ylmethyl...) Show SMILES CC(C)Oc1ccccc1N1CCN(Cc2ccccc2CN2CCCCC2=O)CC1 Show InChI InChI=1S/C26H35N3O2/c1-21(2)31-25-12-6-5-11-24(25)28-17-15-27(16-18-28)19-22-9-3-4-10-23(22)20-29-14-8-7-13-26(29)30/h3-6,9-12,21H,7-8,13-20H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	46	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
R. W. Johnson Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Binding affinity towards dopamine D2 receptors in rat brain synaptosomal preparations				J Med Chem 37: 1060-2 (1994) BindingDB Entry DOI: 10.7270/Q23R0RXB
					More data for this Ligand-Target Pair