Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'D-3-phosphoglycerate dehydrogenase [3-314]'   

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
D-3-phosphoglycerate dehydrogenase [3-314] (Homo sapiens (Human))	BDBM209924 (PKUMDL-WQ-2101 | US10722489, Compound PKUMDL-WL-21...) Show SMILES Oc1ccc(C(=O)N\N=C\c2cc(ccc2O)[N+]([O-])=O)c(O)c1 Show InChI InChI=1S/C14H11N3O6/c18-10-2-3-11(13(20)6-10)14(21)16-15-7-8-5-9(17(22)23)1-4-12(8)19/h1-7,18-20H,(H,16,21)/b15-7+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.01E+4	n/a	n/a	n/a	n/a	7.1	n/a
Peking University					Assay Description To evaluate the effects of compounds on PHGDH activity, compounds were first pre-incubated with enzyme samples in the assay buffer (25 mM HEPES, pH 7...				Cell Chem Biol 24: 55-65 (2017) Article DOI: 10.1016/j.chembiol.2016.11.013 BindingDB Entry DOI: 10.7270/Q2X63KR3
					More data for this Ligand-Target Pair
D-3-phosphoglycerate dehydrogenase [3-314] (Homo sapiens (Human))	BDBM209925 (PKUMDL-WQ-2201) Show SMILES CCNC(=S)N\N=C/c1ccc(o1)-c1ccc(C(O)=O)c(Cl)c1 Show InChI InChI=1S/C15H14ClN3O3S/c1-2-17-15(23)19-18-8-10-4-6-13(22-10)9-3-5-11(14(20)21)12(16)7-9/h3-8H,2H2,1H3,(H,20,21)(H2,17,19,23)/b18-8-	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.50E+4	n/a	n/a	n/a	n/a	7.1	n/a
Peking University					Assay Description To evaluate the effects of compounds on PHGDH activity, compounds were first pre-incubated with enzyme samples in the assay buffer (25 mM HEPES, pH 7...				Cell Chem Biol 24: 55-65 (2017) Article DOI: 10.1016/j.chembiol.2016.11.013 BindingDB Entry DOI: 10.7270/Q2X63KR3
					More data for this Ligand-Target Pair