Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Delta-type opioid receptor' and Ligand = 'BDBM50061290'   

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 (MOUSE)	BDBM50061290 ((S)-2-({(4R,7S,13S)-13-[(S)-2-Amino-3-(4-hydroxy-p...) Show SMILES CC1(C)SSC(C)(C)[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O Show InChI InChI=1S/C39H48N6O8S2/c1-38(2)31(44-33(48)27(40)19-25-15-17-26(46)18-16-25)35(50)41-22-30(47)42-28(20-23-11-7-5-8-12-23)34(49)45-32(39(3,4)55-54-38)36(51)43-29(37(52)53)21-24-13-9-6-10-14-24/h5-18,27-29,31-32,46H,19-22,40H2,1-4H3,(H,41,50)(H,42,47)(H,43,51)(H,44,48)(H,45,49)(H,52,53)/t27-,28-,29-,31-,32+/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	1.90	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Inhibitory potency against Opioid receptor delta 1 was determined in electrically induced smooth muscle contractions of mouse vas deferens (MVD)				J Med Chem 40: 3957-62 (1998) Article DOI: 10.1021/jm9704762 BindingDB Entry DOI: 10.7270/Q23R0TJ7
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50061290 ((S)-2-({(4R,7S,13S)-13-[(S)-2-Amino-3-(4-hydroxy-p...) Show SMILES CC1(C)SSC(C)(C)[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O Show InChI InChI=1S/C39H48N6O8S2/c1-38(2)31(44-33(48)27(40)19-25-15-17-26(46)18-16-25)35(50)41-22-30(47)42-28(20-23-11-7-5-8-12-23)34(49)45-32(39(3,4)55-54-38)36(51)43-29(37(52)53)21-24-13-9-6-10-14-24/h5-18,27-29,31-32,46H,19-22,40H2,1-4H3,(H,41,50)(H,42,47)(H,43,51)(H,44,48)(H,45,49)(H,52,53)/t27-,28-,29-,31-,32+/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	4	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Inhibition of binding of radioligand [3H][p-Cl-phe]-DPDPE to Opioid receptor delta 1 in rat brain				J Med Chem 40: 3957-62 (1998) Article DOI: 10.1021/jm9704762 BindingDB Entry DOI: 10.7270/Q23R0TJ7
					More data for this Ligand-Target Pair