Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'D(2) dopamine receptor' and Ligand = 'BDBM50463991'   

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))	BDBM50463991 (CHEMBL4239573) Show SMILES COc1ccccc1N1CCN(Cc2ccc(OCc3cn(CCOCCOCCOCCOCCOCCNC(=O)COc4cncc(c4)C#Cc4csc(C)n4)nn3)c(OC)c2)CC1 Show InChI InChI=1S/C47H60N8O10S/c1-37-50-40(36-66-37)10-8-38-28-42(31-48-30-38)64-35-47(56)49-12-18-59-20-22-61-24-26-63-27-25-62-23-21-60-19-17-55-33-41(51-52-55)34-65-45-11-9-39(29-46(45)58-3)32-53-13-15-54(16-14-53)43-6-4-5-7-44(43)57-2/h4-7,9,11,28-31,33,36H,12-27,32,34-35H2,1-3H3,(H,49,56)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	186	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ghent University Curated by ChEMBL					Assay Description Displacement of [3H]-Raclopride from recombinant human dopamine D2 receptor expressed in HEK293T cell membranes co-expressing mGluR5a (unknown origin...				J Med Chem 61: 8212-8225 (2018) Article DOI: 10.1021/acs.jmedchem.8b00671 BindingDB Entry DOI: 10.7270/Q2X92DZC
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50463991 (CHEMBL4239573) Show SMILES COc1ccccc1N1CCN(Cc2ccc(OCc3cn(CCOCCOCCOCCOCCOCCNC(=O)COc4cncc(c4)C#Cc4csc(C)n4)nn3)c(OC)c2)CC1 Show InChI InChI=1S/C47H60N8O10S/c1-37-50-40(36-66-37)10-8-38-28-42(31-48-30-38)64-35-47(56)49-12-18-59-20-22-61-24-26-63-27-25-62-23-21-60-19-17-55-33-41(51-52-55)34-65-45-11-9-39(29-46(45)58-3)32-53-13-15-54(16-14-53)43-6-4-5-7-44(43)57-2/h4-7,9,11,28-31,33,36H,12-27,32,34-35H2,1-3H3,(H,49,56)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	352	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ghent University Curated by ChEMBL					Assay Description Displacement of [3H]-Raclopride from recombinant human dopamine D2 receptor expressed in HEK293T cell membranes after 1 hr by liquid scintillation co...				J Med Chem 61: 8212-8225 (2018) Article DOI: 10.1021/acs.jmedchem.8b00671 BindingDB Entry DOI: 10.7270/Q2X92DZC
					More data for this Ligand-Target Pair