Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Delta-type opioid receptor' and Ligand = 'BDBM50100461'   

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)	BDBM50100461 (4`-guanidino-17-(cyclopropylmethyl)-6,7-didehydro-...) Show SMILES NC(N)=Nc1cccc2[nH]c3[C@@H]4Oc5c6c(CC7N(CC8CC8)CC[C@@]46[C@@]7(O)Cc3c12)ccc5O |wU:26.30,wD:25.27,11.11,TLB:13:14:26:18.24.23,31:15:26:18.24.23,(11.34,-12.46,;12.23,-13.7,;13.75,-13.56,;11.58,-15.1,;12.47,-16.36,;14,-16.22,;14.87,-17.48,;14.24,-18.86,;12.72,-19,;11.81,-20.24,;10.36,-19.75,;9.01,-20.49,;8.59,-21.98,;6.37,-21.99,;6.37,-20.45,;5.04,-19.68,;5.05,-18.14,;6.39,-17.38,;6.42,-15.84,;5.09,-15.06,;5.09,-13.52,;4.32,-12.18,;5.88,-12.19,;5.32,-16.92,;5.72,-18.42,;7.68,-19.7,;7.72,-18.16,;8.12,-16.67,;9.06,-17.41,;10.38,-18.21,;11.84,-17.76,;3.72,-20.45,;3.72,-21.99,;5.04,-22.76,;5.04,-24.3,)| Show InChI InChI=1S/C27H29N5O3/c28-25(29)31-17-3-1-2-16-20(17)15-11-27(34)19-10-14-6-7-18(33)23-21(14)26(27,24(35-23)22(15)30-16)8-9-32(19)12-13-4-5-13/h1-3,6-7,13,19,24,30,33-34H,4-5,8-12H2,(H4,28,29,31)/t19?,24-,26-,27+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Minnesota Curated by ChEMBL					Assay Description Binding affinity towards mouse delta-opioid receptor was determined using [3H]diprenorphine as radioligand				J Med Chem 44: 2073-9 (2001) BindingDB Entry DOI: 10.7270/Q2416XRH
					More data for this Ligand-Target Pair