Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Delta-type opioid receptor' and Ligand = 'BDBM50254120'   

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 (Homo sapiens (Human))	BDBM50254120 (CHEMBL4076681) Show SMILES [H][C@]12CN(C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)C(=O)Oc1ccccc1 |r,TLB:17:18:4.6.5:8.1,16:17:7:21.20.19,6:7:21.20.19:10.11.17,8:7:21.20.19:10.11.17,2:1:18:4.6.5,3:4:18:8.1,22:21:7:10.11.17,THB:12:11:7:21.20.19,19:18:4.6.5:8.1| Show InChI InChI=1S/C30H34N2O3/c33-22-9-8-20-14-26-29-11-10-25-27(30(29,24(20)15-22)12-13-31(26)17-19-6-7-19)21(16-29)18-32(25)28(34)35-23-4-2-1-3-5-23/h1-5,8-9,15,19,21,25-27,33H,6-7,10-14,16-18H2/t21-,25?,26?,27?,29?,30?/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	0.833	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Nippon Chemiphar Co., Ltd Curated by ChEMBL					Assay Description Displacement of [3H]DPDPE from human recombinant DOR expressed in CHO cell membranes				Bioorg Med Chem Lett 27: 3495-3498 (2017) Article DOI: 10.1016/j.bmcl.2017.05.072 BindingDB Entry DOI: 10.7270/Q25H7JPK
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50254120 (CHEMBL4076681) Show SMILES [H][C@]12CN(C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)C(=O)Oc1ccccc1 |r,TLB:17:18:4.6.5:8.1,16:17:7:21.20.19,6:7:21.20.19:10.11.17,8:7:21.20.19:10.11.17,2:1:18:4.6.5,3:4:18:8.1,22:21:7:10.11.17,THB:12:11:7:21.20.19,19:18:4.6.5:8.1| Show InChI InChI=1S/C30H34N2O3/c33-22-9-8-20-14-26-29-11-10-25-27(30(29,24(20)15-22)12-13-31(26)17-19-6-7-19)21(16-29)18-32(25)28(34)35-23-4-2-1-3-5-23/h1-5,8-9,15,19,21,25-27,33H,6-7,10-14,16-18H2/t21-,25?,26?,27?,29?,30?/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.30	n/a	n/a	n/a	n/a
Nippon Chemiphar Co., Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant DOR expressed in CHO cells assessed as cAMP accumulation				Bioorg Med Chem Lett 27: 3495-3498 (2017) Article DOI: 10.1016/j.bmcl.2017.05.072 BindingDB Entry DOI: 10.7270/Q25H7JPK
					More data for this Ligand-Target Pair