Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Delta-type opioid receptor' and Ligand = 'BDBM50199859'   

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
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50199859 ((S)-N-((S)-1-((S)-1-(allylamino)-1-oxo-3-phenylpro...) Show SMILES Cc1cc(O)cc(C)c1C[C@H](NCC=C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC=C Show InChI InChI=1S/C42H50N6O5/c1-5-18-43-37(25-33-27(3)21-31(49)22-28(33)4)42(53)48-20-12-17-38(48)41(52)47-36(24-30-26-45-34-16-11-10-15-32(30)34)40(51)46-35(39(50)44-19-6-2)23-29-13-8-7-9-14-29/h5-11,13-16,21-22,26,35-38,43,45,49H,1-2,12,17-20,23-25H2,3-4H3,(H,44,50)(H,46,51)(H,47,52)/t35-,36-,37-,38-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	217	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Displacement of [3H]deltorphin 2 from delta opioid receptor in rat brain P2 synaptosome				Bioorg Med Chem 15: 1237-51 (2007) Article DOI: 10.1016/j.bmc.2006.11.019 BindingDB Entry DOI: 10.7270/Q2348K1F
					More data for this Ligand-Target Pair
Delta-type opioid receptor (MOUSE)	BDBM50199859 ((S)-N-((S)-1-((S)-1-(allylamino)-1-oxo-3-phenylpro...) Show SMILES Cc1cc(O)cc(C)c1C[C@H](NCC=C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC=C Show InChI InChI=1S/C42H50N6O5/c1-5-18-43-37(25-33-27(3)21-31(49)22-28(33)4)42(53)48-20-12-17-38(48)41(52)47-36(24-30-26-45-34-16-11-10-15-32(30)34)40(51)46-35(39(50)44-19-6-2)23-29-13-8-7-9-14-29/h5-11,13-16,21-22,26,35-38,43,45,49H,1-2,12,17-20,23-25H2,3-4H3,(H,44,50)(H,46,51)(H,47,52)/t35-,36-,37-,38-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Agonist activity at delta opioid receptor in mouse vas deferens assessed as inhibition of electrically evoked muscle contractions				Bioorg Med Chem 15: 1237-51 (2007) Article DOI: 10.1016/j.bmc.2006.11.019 BindingDB Entry DOI: 10.7270/Q2348K1F
					More data for this Ligand-Target Pair