Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'D(3) dopamine receptor' and Ligand = 'BDBM50139921'   

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(3) dopamine receptor (Homo sapiens (Human))	BDBM50139921 (CHEMBL3764597 | US10577361, E35) Show SMILES Cn1c(SCCCN2CCOC(C2)c2ccc(cc2F)C(F)(F)F)nnc1-c1ccc(cc1)C(N)=O Show InChI InChI=1S/C24H25F4N5O2S/c1-32-22(16-5-3-15(4-6-16)21(29)34)30-31-23(32)36-12-2-9-33-10-11-35-20(14-33)18-8-7-17(13-19(18)25)24(26,27)28/h3-8,13,20H,2,9-12,14H2,1H3,(H2,29,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Aptuit s.r.l Curated by ChEMBL					Assay Description Agonist activity at human dopamine D3 receptor expressed in CHO cells after 90 mins by [35S]-GTPgamma S assay				Bioorg Med Chem Lett 26: 1329-32 (2016) Article DOI: 10.1016/j.bmcl.2015.12.081 BindingDB Entry DOI: 10.7270/Q2HM5B83
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Rattus norvegicus (Rat))	BDBM50139921 (CHEMBL3764597 | US10577361, E35) Show SMILES Cn1c(SCCCN2CCOC(C2)c2ccc(cc2F)C(F)(F)F)nnc1-c1ccc(cc1)C(N)=O Show InChI InChI=1S/C24H25F4N5O2S/c1-32-22(16-5-3-15(4-6-16)21(29)34)30-31-23(32)36-12-2-9-33-10-11-35-20(14-33)18-8-7-17(13-19(18)25)24(26,27)28/h3-8,13,20H,2,9-12,14H2,1H3,(H2,29,34)	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	63	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Aptuit s.r.l Curated by ChEMBL					Assay Description Displacement of [125I]-7-OH-PIPAT from rat brain dopamine D3 receptor after 45 mins by microplate scintillation counting analysis				Bioorg Med Chem Lett 26: 1329-32 (2016) Article DOI: 10.1016/j.bmcl.2015.12.081 BindingDB Entry DOI: 10.7270/Q2HM5B83
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50139921 (CHEMBL3764597 | US10577361, E35) Show SMILES Cn1c(SCCCN2CCOC(C2)c2ccc(cc2F)C(F)(F)F)nnc1-c1ccc(cc1)C(N)=O Show InChI InChI=1S/C24H25F4N5O2S/c1-32-22(16-5-3-15(4-6-16)21(29)34)30-31-23(32)36-12-2-9-33-10-11-35-20(14-33)18-8-7-17(13-19(18)25)24(26,27)28/h3-8,13,20H,2,9-12,14H2,1H3,(H2,29,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	87.1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
INDIVIOR UK LIMITED US Patent					Assay Description [3H]-Spiperone Binding Assay at hD3 and hD4 recombinant receptors CHO cells transiently transfected with human dopamine type 3 or 4 receptors (CHO-hD...				US Patent US10577361 (2020) BindingDB Entry DOI: 10.7270/Q2GQ715H
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50139921 (CHEMBL3764597 | US10577361, E35) Show SMILES Cn1c(SCCCN2CCOC(C2)c2ccc(cc2F)C(F)(F)F)nnc1-c1ccc(cc1)C(N)=O Show InChI InChI=1S/C24H25F4N5O2S/c1-32-22(16-5-3-15(4-6-16)21(29)34)30-31-23(32)36-12-2-9-33-10-11-35-20(14-33)18-8-7-17(13-19(18)25)24(26,27)28/h3-8,13,20H,2,9-12,14H2,1H3,(H2,29,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	<1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Aptuit s.r.l Curated by ChEMBL					Assay Description Agonist activity at human dopamine D3 receptor expressed in CHO cells after 90 mins by [35S]-GTPgamma S assay				Bioorg Med Chem Lett 26: 1329-32 (2016) Article DOI: 10.1016/j.bmcl.2015.12.081 BindingDB Entry DOI: 10.7270/Q2HM5B83
					More data for this Ligand-Target Pair