Compile Data Set for Download or QSAR

Found 16 hits with Last Name = 'pandey' and Initial = 'rr'   

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
Serine/threonine-protein kinase PknB (Mycobacterium tuberculosis)	BDBM50035670 (CHEMBL3338456) Show SMILES NNC(=O)CC(=O)Nc1ccc(F)c(Cl)c1 Show InChI InChI=1S/C9H9ClFN3O2/c10-6-3-5(1-2-7(6)11)13-8(15)4-9(16)14-12/h1-3H,4,12H2,(H,13,15)(H,14,16)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.53E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Central Drug Research Institute Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis PknB				Bioorg Med Chem Lett 24: 5181-4 (2014) Article DOI: 10.1016/j.bmcl.2014.09.080 BindingDB Entry DOI: 10.7270/Q29G5PDS
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase PknB (Mycobacterium tuberculosis)	BDBM50035656 (CHEMBL1986389) Show SMILES NNC(=O)CC(=O)Nc1ccc(cc1)C(O)=O Show InChI InChI=1S/C10H11N3O4/c11-13-9(15)5-8(14)12-7-3-1-6(2-4-7)10(16)17/h1-4H,5,11H2,(H,12,14)(H,13,15)(H,16,17)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.86E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Central Drug Research Institute Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis PknB				Bioorg Med Chem Lett 24: 5181-4 (2014) Article DOI: 10.1016/j.bmcl.2014.09.080 BindingDB Entry DOI: 10.7270/Q29G5PDS
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase PknB (Mycobacterium tuberculosis)	BDBM50035662 (CHEMBL3338464) Show SMILES COc1ccc(NC(=O)CC(=O)NN)c(OC)c1 Show InChI InChI=1S/C11H15N3O4/c1-17-7-3-4-8(9(5-7)18-2)13-10(15)6-11(16)14-12/h3-5H,6,12H2,1-2H3,(H,13,15)(H,14,16)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.25E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Central Drug Research Institute Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis PknB				Bioorg Med Chem Lett 24: 5181-4 (2014) Article DOI: 10.1016/j.bmcl.2014.09.080 BindingDB Entry DOI: 10.7270/Q29G5PDS
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase PknB (Mycobacterium tuberculosis)	BDBM50035666 (CHEMBL3338460) Show SMILES NNC(=O)CC(=O)Nc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O Show InChI InChI=1S/C9H9N5O6/c10-12-9(16)4-8(15)11-6-2-1-5(13(17)18)3-7(6)14(19)20/h1-3H,4,10H2,(H,11,15)(H,12,16)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.38E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Central Drug Research Institute Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis PknB				Bioorg Med Chem Lett 24: 5181-4 (2014) Article DOI: 10.1016/j.bmcl.2014.09.080 BindingDB Entry DOI: 10.7270/Q29G5PDS
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase PknB (Mycobacterium tuberculosis)	BDBM50035663 (CHEMBL3338463) Show SMILES COc1ccc(OC)c(NC(=O)CC(=O)NN)c1 Show InChI InChI=1S/C11H15N3O4/c1-17-7-3-4-9(18-2)8(5-7)13-10(15)6-11(16)14-12/h3-5H,6,12H2,1-2H3,(H,13,15)(H,14,16)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	7.01E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Central Drug Research Institute Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis PknB				Bioorg Med Chem Lett 24: 5181-4 (2014) Article DOI: 10.1016/j.bmcl.2014.09.080 BindingDB Entry DOI: 10.7270/Q29G5PDS
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase PknB (Mycobacterium tuberculosis)	BDBM50035657 (CHEMBL3338469) Show SMILES NNC(=O)CC(=O)Nc1ccccc1C(O)=O Show InChI InChI=1S/C10H11N3O4/c11-13-9(15)5-8(14)12-7-4-2-1-3-6(7)10(16)17/h1-4H,5,11H2,(H,12,14)(H,13,15)(H,16,17)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.32E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Central Drug Research Institute Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis PknB				Bioorg Med Chem Lett 24: 5181-4 (2014) Article DOI: 10.1016/j.bmcl.2014.09.080 BindingDB Entry DOI: 10.7270/Q29G5PDS
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase PknB (Mycobacterium tuberculosis)	BDBM50035658 (CHEMBL3338468) Show SMILES NNC(=O)CC(=O)Nc1ccc(cc1)S(O)(=O)=O Show InChI InChI=1S/C9H11N3O5S/c10-12-9(14)5-8(13)11-6-1-3-7(4-2-6)18(15,16)17/h1-4H,5,10H2,(H,11,13)(H,12,14)(H,15,16,17)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	7.59E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Central Drug Research Institute Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis PknB				Bioorg Med Chem Lett 24: 5181-4 (2014) Article DOI: 10.1016/j.bmcl.2014.09.080 BindingDB Entry DOI: 10.7270/Q29G5PDS
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase PknB (Mycobacterium tuberculosis)	BDBM50035665 (CHEMBL3338461) Show SMILES NNC(=O)CC(=O)Nc1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C9H9Cl2N3O2/c10-5-1-6(11)3-7(2-5)13-8(15)4-9(16)14-12/h1-3H,4,12H2,(H,13,15)(H,14,16)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.68E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Central Drug Research Institute Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis PknB				Bioorg Med Chem Lett 24: 5181-4 (2014) Article DOI: 10.1016/j.bmcl.2014.09.080 BindingDB Entry DOI: 10.7270/Q29G5PDS
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase PknB (Mycobacterium tuberculosis)	BDBM50035659 (CHEMBL3338467) Show SMILES CCCc1ccc(NC(=O)CC(=O)NN)cc1 Show InChI InChI=1S/C12H17N3O2/c1-2-3-9-4-6-10(7-5-9)14-11(16)8-12(17)15-13/h4-7H,2-3,8,13H2,1H3,(H,14,16)(H,15,17)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	9.04E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Central Drug Research Institute Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis PknB				Bioorg Med Chem Lett 24: 5181-4 (2014) Article DOI: 10.1016/j.bmcl.2014.09.080 BindingDB Entry DOI: 10.7270/Q29G5PDS
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase PknB (Mycobacterium tuberculosis)	BDBM50035664 (CHEMBL3338462) Show SMILES NNC(=O)CC(=O)Nc1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C9H9Cl2N3O2/c10-6-2-1-5(3-7(6)11)13-8(15)4-9(16)14-12/h1-3H,4,12H2,(H,13,15)(H,14,16)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	9.21E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Central Drug Research Institute Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis PknB				Bioorg Med Chem Lett 24: 5181-4 (2014) Article DOI: 10.1016/j.bmcl.2014.09.080 BindingDB Entry DOI: 10.7270/Q29G5PDS
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase PknB (Mycobacterium tuberculosis)	BDBM50035667 (CHEMBL3338459) Show SMILES NNC(=O)CC(=O)Nc1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C9H10N4O4/c10-12-9(15)5-8(14)11-6-1-3-7(4-2-6)13(16)17/h1-4H,5,10H2,(H,11,14)(H,12,15)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem	Article PubMed	1.08E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Central Drug Research Institute Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis PknB				Bioorg Med Chem Lett 24: 5181-4 (2014) Article DOI: 10.1016/j.bmcl.2014.09.080 BindingDB Entry DOI: 10.7270/Q29G5PDS
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase PknB (Mycobacterium tuberculosis)	BDBM50035668 (CHEMBL3338458) Show SMILES NNC(=O)CC(=O)Nc1cccc(c1)[N+]([O-])=O Show InChI InChI=1S/C9H10N4O4/c10-12-9(15)5-8(14)11-6-2-1-3-7(4-6)13(16)17/h1-4H,5,10H2,(H,11,14)(H,12,15)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1.25E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Central Drug Research Institute Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis PknB				Bioorg Med Chem Lett 24: 5181-4 (2014) Article DOI: 10.1016/j.bmcl.2014.09.080 BindingDB Entry DOI: 10.7270/Q29G5PDS
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase PknB (Mycobacterium tuberculosis)	BDBM50035661 (CHEMBL3338465) Show SMILES CCN(CC)c1ccc(NC(=O)CC(=O)NN)cc1 Show InChI InChI=1S/C13H20N4O2/c1-3-17(4-2)11-7-5-10(6-8-11)15-12(18)9-13(19)16-14/h5-8H,3-4,9,14H2,1-2H3,(H,15,18)(H,16,19)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.31E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Central Drug Research Institute Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis PknB				Bioorg Med Chem Lett 24: 5181-4 (2014) Article DOI: 10.1016/j.bmcl.2014.09.080 BindingDB Entry DOI: 10.7270/Q29G5PDS
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase PknB (Mycobacterium tuberculosis)	BDBM50035655 (CHEMBL3338470) Show SMILES NNC(=O)CC(=O)NCc1ccco1 Show InChI InChI=1S/C8H11N3O3/c9-11-8(13)4-7(12)10-5-6-2-1-3-14-6/h1-3H,4-5,9H2,(H,10,12)(H,11,13)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.85E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Central Drug Research Institute Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis PknB				Bioorg Med Chem Lett 24: 5181-4 (2014) Article DOI: 10.1016/j.bmcl.2014.09.080 BindingDB Entry DOI: 10.7270/Q29G5PDS
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase PknB (Mycobacterium tuberculosis)	BDBM50035669 (CHEMBL3338457) Show SMILES NNC(=O)CC(=O)Nc1ccccc1[N+]([O-])=O Show InChI InChI=1S/C9H10N4O4/c10-12-9(15)5-8(14)11-6-3-1-2-4-7(6)13(16)17/h1-4H,5,10H2,(H,11,14)(H,12,15)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.29E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Central Drug Research Institute Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis PknB				Bioorg Med Chem Lett 24: 5181-4 (2014) Article DOI: 10.1016/j.bmcl.2014.09.080 BindingDB Entry DOI: 10.7270/Q29G5PDS
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase PknB (Mycobacterium tuberculosis)	BDBM50035660 (CHEMBL3338466) Show SMILES CCCCc1ccc(NC(=O)CC(=O)NN)cc1 Show InChI InChI=1S/C13H19N3O2/c1-2-3-4-10-5-7-11(8-6-10)15-12(17)9-13(18)16-14/h5-8H,2-4,9,14H2,1H3,(H,15,17)(H,16,18)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	2.65E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Central Drug Research Institute Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis PknB				Bioorg Med Chem Lett 24: 5181-4 (2014) Article DOI: 10.1016/j.bmcl.2014.09.080 BindingDB Entry DOI: 10.7270/Q29G5PDS
					More data for this Ligand-Target Pair