Compile Data Set for Download or QSAR

Found 6 hits with Last Name = 'bernardi' and Initial = 'd'   

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
Transcription factor p65 (Homo sapiens (Human))	BDBM50543887 (CHEMBL4649115) Show SMILES CC(C)(C=C)c1cc(C(=O)c2c(oc3cc(O)ccc23)-c2cc(c(O)cc2O)-c2cc3cc(c(O)cc3oc2=O)C(C)(C)C=C)c(O)cc1O Show InChI InChI=1S/C40H34O10/c1-7-39(3,4)26-12-19-11-23(38(48)50-33(19)18-32(26)46)22-14-25(30(44)16-28(22)42)37-35(21-10-9-20(41)13-34(21)49-37)36(47)24-15-27(40(5,6)8-2)31(45)17-29(24)43/h7-18,41-46H,1-2H2,3-6H3	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of NF-kappaB p65 in human HeLa cells nuclear extract by chemiluminescent assay				J Nat Prod 83: 1784-1793 (2020) Article DOI: 10.1021/acs.jnatprod.9b01136 BindingDB Entry DOI: 10.7270/Q2SX6HSV
					More data for this Ligand-Target Pair
UDP-N-acetylglucosamine 1-carboxyvinyltransferase (Escherichia coli K-12 (Enterobacteria))	BDBM50024894 ((1R, 2S)-1,2-epoxypropyl-phosphonic acid | (2R,3S)...) Show SMILES C[C@@H]1O[C@@H]1P(O)(O)=O |r| Show InChI InChI=1S/C3H7O4P/c1-2-3(7-2)8(4,5)6/h2-3H,1H3,(H2,4,5,6)/t2-,3+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	DrugBank Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Escherichia coli MurA expressed in Escherichia coli BL21(lamdaDE3) using UNAG and PEP as substrate incubated for 10 mins prior to PEP a...				Bioorg Med Chem 21: 795-804 (2013) Article DOI: 10.1016/j.bmc.2012.11.018 BindingDB Entry DOI: 10.7270/Q2HM59SD
					More data for this Ligand-Target Pair
UDP-N-acetylglucosamine 1-carboxyvinyltransferase (Escherichia coli K-12 (Enterobacteria))	BDBM50428795 (CHEMBL2335230 | MurA inhibitor (compound 7)) Show SMILES [O-][N+](=O)C(\Br)=C\c1ccc(Br)o1 Show InChI InChI=1S/C6H3Br2NO3/c7-5(9(10)11)3-4-1-2-6(8)12-4/h1-3H/b5-3+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Escherichia coli MurA expressed in Escherichia coli BL21(lamdaDE3) using UNAG and PEP as substrate incubated for 10 mins prior to PEP a...				Bioorg Med Chem 21: 795-804 (2013) Article DOI: 10.1016/j.bmc.2012.11.018 BindingDB Entry DOI: 10.7270/Q2HM59SD
					More data for this Ligand-Target Pair
UDP-N-acetylglucosamine 1-carboxyvinyltransferase (Escherichia coli K-12 (Enterobacteria))	BDBM50428793 (Bromo(Nitro)Methane | CHEMBL2335229) Show SMILES [O-][N+](=O)CBr Show InChI InChI=1S/CH2BrNO2/c2-1-3(4)5/h1H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Escherichia coli MurA expressed in Escherichia coli BL21(lamdaDE3) using UNAG and PEP as substrate incubated for 10 mins prior to PEP a...				Bioorg Med Chem 21: 795-804 (2013) Article DOI: 10.1016/j.bmc.2012.11.018 BindingDB Entry DOI: 10.7270/Q2HM59SD
					More data for this Ligand-Target Pair
UDP-N-acetylglucosamine 1-carboxyvinyltransferase (Escherichia coli K-12 (Enterobacteria))	BDBM50370832 (CNICIN) Show SMILES CC1=CCC\C(CO)=C\[C@H]2OC(=O)C(=C)[C@@H]2[C@H](C1)OC(=O)C(=C)[C@H](O)CO |r,t:7| Show InChI InChI=1S/C20H26O7/c1-11-5-4-6-14(9-21)8-17-18(13(3)20(25)27-17)16(7-11)26-19(24)12(2)15(23)10-22/h5,8,15-18,21-23H,2-4,6-7,9-10H2,1H3/b11-5-,14-8-/t15-,16+,17-,18-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.67E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Escherichia coli MurA expressed in Escherichia coli BL21(lamdaDE3) using UNAG and PEP as substrate incubated for 10 mins prior to PEP a...				Bioorg Med Chem 21: 795-804 (2013) Article DOI: 10.1016/j.bmc.2012.11.018 BindingDB Entry DOI: 10.7270/Q2HM59SD
					More data for this Ligand-Target Pair
UDP-N-acetylglucosamine 1-carboxyvinyltransferase (Escherichia coli K-12 (Enterobacteria))	BDBM50428794 (CHEMBL2335231) Show SMILES [O-][N+](=O)\C=C\c1ccc(Br)o1 Show InChI InChI=1S/C6H4BrNO3/c7-6-2-1-5(11-6)3-4-8(9)10/h1-4H/b4-3+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.73E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heidelberg University Curated by ChEMBL					Assay Description Inhibition of Escherichia coli MurA expressed in Escherichia coli BL21(lamdaDE3) using UNAG and PEP as substrate incubated for 10 mins prior to PEP a...				Bioorg Med Chem 21: 795-804 (2013) Article DOI: 10.1016/j.bmc.2012.11.018 BindingDB Entry DOI: 10.7270/Q2HM59SD
					More data for this Ligand-Target Pair