Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Glutamate receptor ionotropic, NMDA 2B' and Ligand = 'BDBM50269780'   

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
Glutamate receptor ionotropic, NMDA 2B (Mus musculus)	BDBM50269780 (CHEMBL4095807) Show SMILES COc1ccc(C[C@H]2CC[C@](O)(CC(=O)Nc3ccc4[nH]c(=O)oc4c3)CC2)cc1 |r,wD:10.10,7.6,(25.46,-11.71,;24.13,-10.94,;22.79,-11.71,;22.79,-13.25,;21.46,-14.02,;20.13,-13.24,;18.79,-14.01,;17.46,-13.24,;17.46,-11.7,;16.13,-10.92,;14.8,-11.7,;14.03,-10.36,;13.26,-11.7,;12.49,-13.03,;13.26,-14.37,;10.95,-13.03,;10.18,-14.37,;10.96,-15.69,;10.19,-17.02,;8.65,-17.03,;7.62,-18.18,;6.2,-17.55,;4.87,-18.33,;6.36,-16.02,;7.87,-15.69,;8.65,-14.36,;14.8,-13.24,;16.13,-14,;20.12,-11.71,;21.45,-10.94,)| Show InChI InChI=1S/C23H26N2O5/c1-29-18-5-2-15(3-6-18)12-16-8-10-23(28,11-9-16)14-21(26)24-17-4-7-19-20(13-17)30-22(27)25-19/h2-7,13,16,28H,8-12,14H2,1H3,(H,24,26)(H,25,27)/t16-,23+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
Medicinal Chemistry Research Laboratory, Shionogi& Co Ltd, 1-1 Futabacho, 3-chome, Toyonaka 561-0825, Japan. Electronic address: kousuke.anan@shionogi.co.jp. Curated by ChEMBL					Assay Description Antagonist activity at mouse NR2B expressed in Hek293 cells co-expressing mouse NR1 assessed as inhibition of glutamic acid/glycine-induced intracell...				Bioorg Med Chem Lett 27: 4194-4198 (2017) Article DOI: 10.1016/j.bmcl.2017.06.076 BindingDB Entry DOI: 10.7270/Q2VX0K0Q
					More data for this Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 2B (Rattus norvegicus (Rat))	BDBM50269780 (CHEMBL4095807) Show SMILES COc1ccc(C[C@H]2CC[C@](O)(CC(=O)Nc3ccc4[nH]c(=O)oc4c3)CC2)cc1 |r,wD:10.10,7.6,(25.46,-11.71,;24.13,-10.94,;22.79,-11.71,;22.79,-13.25,;21.46,-14.02,;20.13,-13.24,;18.79,-14.01,;17.46,-13.24,;17.46,-11.7,;16.13,-10.92,;14.8,-11.7,;14.03,-10.36,;13.26,-11.7,;12.49,-13.03,;13.26,-14.37,;10.95,-13.03,;10.18,-14.37,;10.96,-15.69,;10.19,-17.02,;8.65,-17.03,;7.62,-18.18,;6.2,-17.55,;4.87,-18.33,;6.36,-16.02,;7.87,-15.69,;8.65,-14.36,;14.8,-13.24,;16.13,-14,;20.12,-11.71,;21.45,-10.94,)| Show InChI InChI=1S/C23H26N2O5/c1-29-18-5-2-15(3-6-18)12-16-8-10-23(28,11-9-16)14-21(26)24-17-4-7-19-20(13-17)30-22(27)25-19/h2-7,13,16,28H,8-12,14H2,1H3,(H,24,26)(H,25,27)/t16-,23+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	63	n/a	n/a	n/a	n/a	n/a	n/a
Medicinal Chemistry Research Laboratory, Shionogi& Co Ltd, 1-1 Futabacho, 3-chome, Toyonaka 561-0825, Japan. Electronic address: kousuke.anan@shionogi.co.jp. Curated by ChEMBL					Assay Description Displacement of [3H]-ifenprodil from NR2B in Wistar rat brain membrane after 120 mins by liquid scintillation counting analysis				Bioorg Med Chem Lett 27: 4194-4198 (2017) Article DOI: 10.1016/j.bmcl.2017.06.076 BindingDB Entry DOI: 10.7270/Q2VX0K0Q
					More data for this Ligand-Target Pair