Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'D(4) dopamine receptor' and Ligand = 'BDBM50505711'   

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))	BDBM50505711 (CHEMBL4442419) Show SMILES COc1ccc(cc1)N(Cc1cccc(OC)c1)NC(=O)NCCCN1CCN(CC1)c1ccccc1OC Show InChI InChI=1S/C30H39N5O4/c1-37-26-14-12-25(13-15-26)35(23-24-8-6-9-27(22-24)38-2)32-30(36)31-16-7-17-33-18-20-34(21-19-33)28-10-4-5-11-29(28)39-3/h4-6,8-15,22H,7,16-21,23H2,1-3H3,(H2,31,32,36)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	33	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Alexander-Universit£t Erlangen-N£rnberg Curated by ChEMBL					Assay Description Displacement of [3H] Spiperone from human D4.4 receptor expressed in CHO cells by competitive radioligand binding assay				J Med Chem 62: 9658-9679 (2019) Article DOI: 10.1021/acs.jmedchem.9b01085 BindingDB Entry DOI: 10.7270/Q2GB27BJ
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