Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'D(4) dopamine receptor' and Ligand = 'BDBM50450987'   

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))	BDBM50450987 (CHEMBL2112913) Show SMILES C(Cc1c[nH]c2ncccc12)N1CCC(\C=C\c2ccccc2)=CC1 |c:25| Show InChI InChI=1S/C22H23N3/c1-2-5-18(6-3-1)8-9-19-10-14-25(15-11-19)16-12-20-17-24-22-21(20)7-4-13-23-22/h1-10,13,17H,11-12,14-16H2,(H,23,24)/b9-8+	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	6.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Research Laboratories Curated by ChEMBL					Assay Description Ability to displace [3H]-spiperone from cloned human dopamine D4 receptor stably expressed in HEK293 cells				Bioorg Med Chem Lett 9: 585-8 (1999) BindingDB Entry DOI: 10.7270/Q2NV9HD4
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