Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'D(2) dopamine receptor' and Ligand = 'BDBM50039781'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50039781 (3-((S)-1-Propyl-piperidin-3-yl)-benzaldehyde | CHE...) Show SMILES CCCN1CCC[C@H](C1)c1cccc(C=O)c1 Show InChI InChI=1S/C15H21NO/c1-2-8-16-9-4-7-15(11-16)14-6-3-5-13(10-14)12-17/h3,5-6,10,12,15H,2,4,7-9,11H2,1H3/t15-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	145	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of G£teborg Curated by ChEMBL					Assay Description Affinity against recombinant dopamine receptor (DA) D2 expressed in CHO-K1 cells, using [3H]-spiperone as radioligand				J Med Chem 37: 2735-53 (1994) BindingDB Entry DOI: 10.7270/Q2J96719
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM50039781 (3-((S)-1-Propyl-piperidin-3-yl)-benzaldehyde | CHE...) Show SMILES CCCN1CCC[C@H](C1)c1cccc(C=O)c1 Show InChI InChI=1S/C15H21NO/c1-2-8-16-9-4-7-15(11-16)14-6-3-5-13(10-14)12-17/h3,5-6,10,12,15H,2,4,7-9,11H2,1H3/t15-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.12E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of G£teborg Curated by ChEMBL					Assay Description Tested for affinity against striatal dopamine autoreceptor (DA) D2 receptors using [3H]spiperone as raidoligand in rats.				J Med Chem 37: 2735-53 (1994) BindingDB Entry DOI: 10.7270/Q2J96719
					More data for this Ligand-Target Pair