Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'D(4) dopamine receptor' and Ligand = 'BDBM50115718'   

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))	BDBM50115718 (1-Phenyl-4-(4-phenylethynyl-1H-pyrrol-2-ylmethyl)-...) Show SMILES C(N1CCN(CC1)c1ccccc1)c1cc(c[nH]1)C#Cc1ccccc1 Show InChI InChI=1S/C23H23N3/c1-3-7-20(8-4-1)11-12-21-17-22(24-18-21)19-25-13-15-26(16-14-25)23-9-5-2-6-10-23/h1-10,17-18,24H,13-16,19H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	83	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Alexander University Curated by ChEMBL					Assay Description Ability to displace [3H]spiperone radioligand from cloned human Dopamine receptor D4 in CHO cells				Bioorg Med Chem Lett 12: 1937-40 (2002) BindingDB Entry DOI: 10.7270/Q2T72J0V
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