Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'D(4) dopamine receptor' and Ligand = 'BDBM50116765'   

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(4) dopamine receptor (Homo sapiens (Human))	BDBM50116765 (3-Propyl-1,2,3,4-tetrahydro-3,8a,9-triaza-fluorene...) Show SMILES CCCN1CCc2nn3ccccc3c2C1 Show InChI InChI=1S/C13H17N3/c1-2-7-15-9-6-12-11(10-15)13-5-3-4-8-16(13)14-12/h3-5,8H,2,6-7,9-10H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	87	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Alexander University Curated by ChEMBL					Assay Description Binding affinity of compound measured using [3H]-spiperone for the cloned human dopamine receptor D4.4 (high/low affinity is given as 87/23000)				Bioorg Med Chem Lett 12: 2377-80 (2002) BindingDB Entry DOI: 10.7270/Q2Z89BRG
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50116765 (3-Propyl-1,2,3,4-tetrahydro-3,8a,9-triaza-fluorene...) Show SMILES CCCN1CCc2nn3ccccc3c2C1 Show InChI InChI=1S/C13H17N3/c1-2-7-15-9-6-12-11(10-15)13-5-3-4-8-16(13)14-12/h3-5,8H,2,6-7,9-10H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a
Friedrich-Alexander University Curated by ChEMBL					Assay Description Effective concentration required for agonistic activity against rat D2 short receptor				Bioorg Med Chem Lett 12: 2377-80 (2002) BindingDB Entry DOI: 10.7270/Q2Z89BRG
					More data for this Ligand-Target Pair