Compile Data Set for Download or QSAR

Found 102 hits of ic50 for UniProtKB: P49137   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30273 (carboline analog, 85) Show SMILES CC1CNC(=O)c2[nH]c3ccc(cc3c12)C(=O)Nc1nc(cs1)C(=O)NC1CCN(C)CC1 Show InChI InChI=1S/C23H26N6O3S/c1-12-10-24-22(32)19-18(12)15-9-13(3-4-16(15)26-19)20(30)28-23-27-17(11-33-23)21(31)25-14-5-7-29(2)8-6-14/h3-4,9,11-12,14,26H,5-8,10H2,1-2H3,(H,24,32)(H,25,31)(H,27,28,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 17: 4664-9 (2007) Article DOI: 10.1016/j.bmcl.2007.05.101 BindingDB Entry DOI: 10.7270/Q23N21QP
					More data for this Ligand-Target Pair				3D Structure (docked)
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30265 (carboline analog, 77) Show SMILES CC1CNC(=O)c2[nH]c3ccc(cc3c12)C(=O)Nc1nc(cs1)C(=O)NCCN Show InChI InChI=1S/C19H20N6O3S/c1-9-7-22-18(28)15-14(9)11-6-10(2-3-12(11)23-15)16(26)25-19-24-13(8-29-19)17(27)21-5-4-20/h2-3,6,8-9,23H,4-5,7,20H2,1H3,(H,21,27)(H,22,28)(H,24,25,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 17: 4664-9 (2007) Article DOI: 10.1016/j.bmcl.2007.05.101 BindingDB Entry DOI: 10.7270/Q23N21QP
					More data for this Ligand-Target Pair				3D Structure (docked)
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30268 (carboline analog, 80) Show SMILES CC1CNC(=O)c2[nH]c3ccc(cc3c12)C(=O)Nc1nc(cs1)C(=O)NCCC(N)=O Show InChI InChI=1S/C20H20N6O4S/c1-9-7-23-19(30)16-15(9)11-6-10(2-3-12(11)24-16)17(28)26-20-25-13(8-31-20)18(29)22-5-4-14(21)27/h2-3,6,8-9,24H,4-5,7H2,1H3,(H2,21,27)(H,22,29)(H,23,30)(H,25,26,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 17: 4664-9 (2007) Article DOI: 10.1016/j.bmcl.2007.05.101 BindingDB Entry DOI: 10.7270/Q23N21QP
					More data for this Ligand-Target Pair				3D Structure (docked)
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30300 (indole-based 7-membered lactam, 25a) Show SMILES NCC1CNC(=O)c2cc3ccc(cc3n2C1)C(=O)Nc1cccnc1 Show InChI InChI=1S/C19H19N5O2/c20-8-12-9-22-19(26)17-6-13-3-4-14(7-16(13)24(17)11-12)18(25)23-15-2-1-5-21-10-15/h1-7,10,12H,8-9,11,20H2,(H,22,26)(H,23,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 18: 1994-9 (2008) Article DOI: 10.1016/j.bmcl.2008.01.119 BindingDB Entry DOI: 10.7270/Q2ZW1J8V
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30269 (carboline analog, 81) Show SMILES CC1CNC(=O)c2[nH]c3ccc(cc3c12)C(=O)Nc1nc(cs1)C(=O)NCCO Show InChI InChI=1S/C19H19N5O4S/c1-9-7-21-18(28)15-14(9)11-6-10(2-3-12(11)22-15)16(26)24-19-23-13(8-29-19)17(27)20-4-5-25/h2-3,6,8-9,22,25H,4-5,7H2,1H3,(H,20,27)(H,21,28)(H,23,24,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	31	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 17: 4664-9 (2007) Article DOI: 10.1016/j.bmcl.2007.05.101 BindingDB Entry DOI: 10.7270/Q23N21QP
					More data for this Ligand-Target Pair				3D Structure (docked)
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30264 (carboline analog, 76) Show SMILES CC1CNC(=O)c2[nH]c3ccc(cc3c12)C(=O)Nc1nc(cs1)C(=O)NCCN(C)C Show InChI InChI=1S/C21H24N6O3S/c1-11-9-23-20(30)17-16(11)13-8-12(4-5-14(13)24-17)18(28)26-21-25-15(10-31-21)19(29)22-6-7-27(2)3/h4-5,8,10-11,24H,6-7,9H2,1-3H3,(H,22,29)(H,23,30)(H,25,26,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	34	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 17: 4664-9 (2007) Article DOI: 10.1016/j.bmcl.2007.05.101 BindingDB Entry DOI: 10.7270/Q23N21QP
					More data for this Ligand-Target Pair				3D Structure (crystal)
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30302 (indole-based 7-membered lactam, 25b) Show SMILES NCC1CNC(=O)c2cc3ccc(cc3n2C1)C(=O)Nc1nccs1 Show InChI InChI=1S/C17H17N5O2S/c18-7-10-8-20-16(24)14-5-11-1-2-12(6-13(11)22(14)9-10)15(23)21-17-19-3-4-25-17/h1-6,10H,7-9,18H2,(H,20,24)(H,19,21,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	35	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 18: 1994-9 (2008) Article DOI: 10.1016/j.bmcl.2008.01.119 BindingDB Entry DOI: 10.7270/Q2ZW1J8V
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30266 (carboline analog, 78) Show SMILES CC1CNC(=O)c2[nH]c3ccc(cc3c12)C(=O)Nc1nc(cs1)C(=O)NCCCN(C)C Show InChI InChI=1S/C22H26N6O3S/c1-12-10-24-21(31)18-17(12)14-9-13(5-6-15(14)25-18)19(29)27-22-26-16(11-32-22)20(30)23-7-4-8-28(2)3/h5-6,9,11-12,25H,4,7-8,10H2,1-3H3,(H,23,30)(H,24,31)(H,26,27,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	35	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 17: 4664-9 (2007) Article DOI: 10.1016/j.bmcl.2007.05.101 BindingDB Entry DOI: 10.7270/Q23N21QP
					More data for this Ligand-Target Pair				3D Structure (docked)
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30271 (carboline analog, 83) Show SMILES CC1CNC(=O)c2[nH]c3ccc(cc3c12)C(=O)Nc1nc(cs1)C(=O)NC1CCCCC1 Show InChI InChI=1S/C23H25N5O3S/c1-12-10-24-22(31)19-18(12)15-9-13(7-8-16(15)26-19)20(29)28-23-27-17(11-32-23)21(30)25-14-5-3-2-4-6-14/h7-9,11-12,14,26H,2-6,10H2,1H3,(H,24,31)(H,25,30)(H,27,28,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	44	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 17: 4664-9 (2007) Article DOI: 10.1016/j.bmcl.2007.05.101 BindingDB Entry DOI: 10.7270/Q23N21QP
					More data for this Ligand-Target Pair				3D Structure (docked)
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30270 (carboline analog, 82) Show SMILES CCCNC(=O)c1csc(NC(=O)c2ccc3[nH]c4c(C(C)CNC4=O)c3c2)n1 Show InChI InChI=1S/C20H21N5O3S/c1-3-6-21-18(27)14-9-29-20(24-14)25-17(26)11-4-5-13-12(7-11)15-10(2)8-22-19(28)16(15)23-13/h4-5,7,9-10,23H,3,6,8H2,1-2H3,(H,21,27)(H,22,28)(H,24,25,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	45	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 17: 4664-9 (2007) Article DOI: 10.1016/j.bmcl.2007.05.101 BindingDB Entry DOI: 10.7270/Q23N21QP
					More data for this Ligand-Target Pair				3D Structure (docked)
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30303 (indole-based 7-membered lactam, 25c) Show SMILES OCC1CNC(=O)c2cc3ccc(cc3n2C1)C(=O)Nc1nccs1 Show InChI InChI=1S/C17H16N4O3S/c22-9-10-7-19-16(24)14-5-11-1-2-12(6-13(11)21(14)8-10)15(23)20-17-18-3-4-25-17/h1-6,10,22H,7-9H2,(H,19,24)(H,18,20,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	52	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 18: 1994-9 (2008) Article DOI: 10.1016/j.bmcl.2008.01.119 BindingDB Entry DOI: 10.7270/Q2ZW1J8V
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30262 (carboline analog, 74) Show SMILES CNC(=O)c1csc(NC(=O)c2ccc3[nH]c4c(C(C)CNC4=O)c3c2)n1 Show InChI InChI=1S/C18H17N5O3S/c1-8-6-20-17(26)14-13(8)10-5-9(3-4-11(10)21-14)15(24)23-18-22-12(7-27-18)16(25)19-2/h3-5,7-8,21H,6H2,1-2H3,(H,19,25)(H,20,26)(H,22,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	72	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 17: 4664-9 (2007) Article DOI: 10.1016/j.bmcl.2007.05.101 BindingDB Entry DOI: 10.7270/Q23N21QP
					More data for this Ligand-Target Pair				3D Structure (docked)
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30259 (carboline analog, 71) Show SMILES CC1CNC(=O)c2[nH]c3ccc(cc3c12)C(=O)Nc1nc(cs1)C(N)=O Show InChI InChI=1S/C17H15N5O3S/c1-7-5-19-16(25)13-12(7)9-4-8(2-3-10(9)20-13)15(24)22-17-21-11(6-26-17)14(18)23/h2-4,6-7,20H,5H2,1H3,(H2,18,23)(H,19,25)(H,21,22,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	83	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 17: 4664-9 (2007) Article DOI: 10.1016/j.bmcl.2007.05.101 BindingDB Entry DOI: 10.7270/Q23N21QP
					More data for this Ligand-Target Pair				3D Structure (docked)
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30261 (carboline analog, 73) Show SMILES CC1CNC(=O)c2[nH]c3ccc(cc3c12)C(=O)Nc1ncc(s1)C(N)=O Show InChI InChI=1S/C17H15N5O3S/c1-7-5-19-16(25)13-12(7)9-4-8(2-3-10(9)21-13)15(24)22-17-20-6-11(26-17)14(18)23/h2-4,6-7,21H,5H2,1H3,(H2,18,23)(H,19,25)(H,20,22,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 17: 4664-9 (2007) Article DOI: 10.1016/j.bmcl.2007.05.101 BindingDB Entry DOI: 10.7270/Q23N21QP
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30267 (carboline analog, 79) Show SMILES CC1CNC(=O)c2[nH]c3ccc(cc3c12)C(=O)Nc1nc(cs1)C(=O)NCC(N)=O Show InChI InChI=1S/C19H18N6O4S/c1-8-5-21-18(29)15-14(8)10-4-9(2-3-11(10)23-15)16(27)25-19-24-12(7-30-19)17(28)22-6-13(20)26/h2-4,7-8,23H,5-6H2,1H3,(H2,20,26)(H,21,29)(H,22,28)(H,24,25,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	124	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 17: 4664-9 (2007) Article DOI: 10.1016/j.bmcl.2007.05.101 BindingDB Entry DOI: 10.7270/Q23N21QP
					More data for this Ligand-Target Pair				3D Structure (docked)
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30279 (indole-based 6-membered lactam, 3b) Show SMILES NCC1Cc2c([nH]c3ccc(cc23)C(=O)Nc2nccs2)C(=O)N1 Show InChI InChI=1S/C16H15N5O2S/c17-7-9-6-11-10-5-8(14(22)21-16-18-3-4-24-16)1-2-12(10)20-13(11)15(23)19-9/h1-5,9,20H,6-7,17H2,(H,19,23)(H,18,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	140	n/a	n/a	n/a	n/a	7.6	25
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 18: 1994-9 (2008) Article DOI: 10.1016/j.bmcl.2008.01.119 BindingDB Entry DOI: 10.7270/Q2ZW1J8V
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30288 (indole-based 6-membered lactam, (R)-4b) Show SMILES NC[C@@H]1Cn2c(cc3ccc(cc23)C(=O)Nc2nccs2)C(=O)N1 |r| Show InChI InChI=1S/C16H15N5O2S/c17-7-11-8-21-12-6-10(14(22)20-16-18-3-4-24-16)2-1-9(12)5-13(21)15(23)19-11/h1-6,11H,7-8,17H2,(H,19,23)(H,18,20,22)/t11-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	7.6	25
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 18: 1994-9 (2008) Article DOI: 10.1016/j.bmcl.2008.01.119 BindingDB Entry DOI: 10.7270/Q2ZW1J8V
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30299 (indole-based 7-membered lactam, 23b) Show SMILES O=C(Nc1nccs1)c1ccc2cc3C(=O)NCCCn3c2c1 Show InChI InChI=1S/C16H14N4O2S/c21-14(19-16-18-5-7-23-16)11-3-2-10-8-13-15(22)17-4-1-6-20(13)12(10)9-11/h2-3,5,7-9H,1,4,6H2,(H,17,22)(H,18,19,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 18: 1994-9 (2008) Article DOI: 10.1016/j.bmcl.2008.01.119 BindingDB Entry DOI: 10.7270/Q2ZW1J8V
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30281 (indole-based 6-membered lactam, 3e) Show SMILES CNCC1Cc2c([nH]c3ccc(cc23)C(=O)Nc2nccs2)C(=O)N1 Show InChI InChI=1S/C17H17N5O2S/c1-18-8-10-7-12-11-6-9(15(23)22-17-19-4-5-25-17)2-3-13(11)21-14(12)16(24)20-10/h2-6,10,18,21H,7-8H2,1H3,(H,20,24)(H,19,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	7.6	25
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 18: 1994-9 (2008) Article DOI: 10.1016/j.bmcl.2008.01.119 BindingDB Entry DOI: 10.7270/Q2ZW1J8V
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30272 (carboline analog, 84) Show SMILES CC1CNC(=O)c2[nH]c3ccc(cc3c12)C(=O)Nc1nc(cs1)C(=O)N1CCC(CC1)N(C)C Show InChI InChI=1S/C24H28N6O3S/c1-13-11-25-22(32)20-19(13)16-10-14(4-5-17(16)26-20)21(31)28-24-27-18(12-34-24)23(33)30-8-6-15(7-9-30)29(2)3/h4-5,10,12-13,15,26H,6-9,11H2,1-3H3,(H,25,32)(H,27,28,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	250	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 17: 4664-9 (2007) Article DOI: 10.1016/j.bmcl.2007.05.101 BindingDB Entry DOI: 10.7270/Q23N21QP
					More data for this Ligand-Target Pair				3D Structure (docked)
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30277 (indole-based 6-membered lactam, 3a) Show SMILES NCC1Cc2c([nH]c3ccc(cc23)C(=O)Nc2cccnc2)C(=O)N1 Show InChI InChI=1S/C18H17N5O2/c19-8-12-7-14-13-6-10(17(24)21-11-2-1-5-20-9-11)3-4-15(13)23-16(14)18(25)22-12/h1-6,9,12,23H,7-8,19H2,(H,21,24)(H,22,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	260	n/a	n/a	n/a	n/a	7.6	25
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 18: 1994-9 (2008) Article DOI: 10.1016/j.bmcl.2008.01.119 BindingDB Entry DOI: 10.7270/Q2ZW1J8V
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30298 (indole-based 7-membered lactam, 23a) Show SMILES O=C(Nc1cccnc1)c1ccc2cc3C(=O)NCCCn3c2c1 Show InChI InChI=1S/C18H16N4O2/c23-17(21-14-3-1-6-19-11-14)13-5-4-12-9-16-18(24)20-7-2-8-22(16)15(12)10-13/h1,3-6,9-11H,2,7-8H2,(H,20,24)(H,21,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 18: 1994-9 (2008) Article DOI: 10.1016/j.bmcl.2008.01.119 BindingDB Entry DOI: 10.7270/Q2ZW1J8V
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30307 (indole-based 7-membered lactam, 25h) Show SMILES CN(C)CC1CNC(=O)c2cc3ccc(cc3n2C1)C(=O)Nc1nccs1 Show InChI InChI=1S/C19H21N5O2S/c1-23(2)10-12-9-21-18(26)16-7-13-3-4-14(8-15(13)24(16)11-12)17(25)22-19-20-5-6-27-19/h3-8,12H,9-11H2,1-2H3,(H,21,26)(H,20,22,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	310	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 18: 1994-9 (2008) Article DOI: 10.1016/j.bmcl.2008.01.119 BindingDB Entry DOI: 10.7270/Q2ZW1J8V
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30301 (indole-based 7-membered lactam, 25d) Show SMILES CC1CNC(=O)c2cc3ccc(cc3n2C1)C(=O)Nc1cccnc1 Show InChI InChI=1S/C19H18N4O2/c1-12-9-21-19(25)17-7-13-4-5-14(8-16(13)23(17)11-12)18(24)22-15-3-2-6-20-10-15/h2-8,10,12H,9,11H2,1H3,(H,21,25)(H,22,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	320	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 18: 1994-9 (2008) Article DOI: 10.1016/j.bmcl.2008.01.119 BindingDB Entry DOI: 10.7270/Q2ZW1J8V
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30284 (indole-based 6-membered lactam, (R)-4a) Show SMILES NC[C@@H]1Cn2c(cc3ccc(cc23)C(=O)Nc2cccnc2)C(=O)N1 |r| Show InChI InChI=1S/C18H17N5O2/c19-8-14-10-23-15-7-12(17(24)21-13-2-1-5-20-9-13)4-3-11(15)6-16(23)18(25)22-14/h1-7,9,14H,8,10,19H2,(H,21,24)(H,22,25)/t14-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	320	n/a	n/a	n/a	n/a	7.6	25
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 18: 1994-9 (2008) Article DOI: 10.1016/j.bmcl.2008.01.119 BindingDB Entry DOI: 10.7270/Q2ZW1J8V
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30263 (carboline analog, 75) Show SMILES CC1CNC(=O)c2[nH]c3ccc(cc3c12)C(=O)Nc1nc(cs1)C(=O)N(C)C Show InChI InChI=1S/C19H19N5O3S/c1-9-7-20-17(26)15-14(9)11-6-10(4-5-12(11)21-15)16(25)23-19-22-13(8-28-19)18(27)24(2)3/h4-6,8-9,21H,7H2,1-3H3,(H,20,26)(H,22,23,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	333	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 17: 4664-9 (2007) Article DOI: 10.1016/j.bmcl.2007.05.101 BindingDB Entry DOI: 10.7270/Q23N21QP
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30228 (carboline analog, 40) Show SMILES CC1CNC(=O)c2[nH]c3ccc(cc3c12)C(=O)Nc1cnccn1 Show InChI InChI=1S/C17H15N5O2/c1-9-7-20-17(24)15-14(9)11-6-10(2-3-12(11)21-15)16(23)22-13-8-18-4-5-19-13/h2-6,8-9,21H,7H2,1H3,(H,20,24)(H,19,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	440	n/a	n/a	n/a	n/a	7.6	25
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 17: 4664-9 (2007) Article DOI: 10.1016/j.bmcl.2007.05.101 BindingDB Entry DOI: 10.7270/Q23N21QP
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30275 (carboline analog, 87) Show SMILES CC1CNC(=O)c2[nH]c3ccc(cc3c12)C(=O)Nc1ncc(s1)C(=O)NCCCN(C)C Show InChI InChI=1S/C22H26N6O3S/c1-12-10-24-21(31)18-17(12)14-9-13(5-6-15(14)26-18)19(29)27-22-25-11-16(32-22)20(30)23-7-4-8-28(2)3/h5-6,9,11-12,26H,4,7-8,10H2,1-3H3,(H,23,30)(H,24,31)(H,25,27,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	480	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 17: 4664-9 (2007) Article DOI: 10.1016/j.bmcl.2007.05.101 BindingDB Entry DOI: 10.7270/Q23N21QP
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30223 (carboline analog, 35) Show SMILES CC1CNC(=O)c2[nH]c3ccc(cc3c12)C(=O)Nc1cccnc1 Show InChI InChI=1S/C18H16N4O2/c1-10-8-20-18(24)16-15(10)13-7-11(4-5-14(13)22-16)17(23)21-12-3-2-6-19-9-12/h2-7,9-10,22H,8H2,1H3,(H,20,24)(H,21,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	520	n/a	n/a	n/a	n/a	7.6	25
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 17: 4664-9 (2007) Article DOI: 10.1016/j.bmcl.2007.05.101 BindingDB Entry DOI: 10.7270/Q23N21QP
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30304 (indole-based 7-membered lactam, 25e) Show SMILES CC1CNC(=O)c2cc3ccc(cc3n2C1)C(=O)Nc1nccs1 Show InChI InChI=1S/C17H16N4O2S/c1-10-8-19-16(23)14-6-11-2-3-12(7-13(11)21(14)9-10)15(22)20-17-18-4-5-24-17/h2-7,10H,8-9H2,1H3,(H,19,23)(H,18,20,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	530	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 18: 1994-9 (2008) Article DOI: 10.1016/j.bmcl.2008.01.119 BindingDB Entry DOI: 10.7270/Q2ZW1J8V
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30290 (indole-based 6-membered lactam, 4c) Show SMILES OCC1Cn2c(cc3ccc(cc23)C(=O)Nc2nccs2)C(=O)N1 Show InChI InChI=1S/C16H14N4O3S/c21-8-11-7-20-12-6-10(14(22)19-16-17-3-4-24-16)2-1-9(12)5-13(20)15(23)18-11/h1-6,11,21H,7-8H2,(H,18,23)(H,17,19,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	550	n/a	n/a	n/a	n/a	7.6	25
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 18: 1994-9 (2008) Article DOI: 10.1016/j.bmcl.2008.01.119 BindingDB Entry DOI: 10.7270/Q2ZW1J8V
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30306 (indole-based 7-membered lactam, 25g) Show SMILES CCNCC1CNC(=O)c2cc3ccc(cc3n2C1)C(=O)Nc1nccs1 Show InChI InChI=1S/C19H21N5O2S/c1-2-20-9-12-10-22-18(26)16-7-13-3-4-14(8-15(13)24(16)11-12)17(25)23-19-21-5-6-27-19/h3-8,12,20H,2,9-11H2,1H3,(H,22,26)(H,21,23,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	560	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 18: 1994-9 (2008) Article DOI: 10.1016/j.bmcl.2008.01.119 BindingDB Entry DOI: 10.7270/Q2ZW1J8V
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30292 (indole-based 6-membered lactam, 4f) Show SMILES CNCC1Cn2c(cc3ccc(cc23)C(=O)Nc2nccs2)C(=O)N1 Show InChI InChI=1S/C17H17N5O2S/c1-18-8-12-9-22-13-7-11(15(23)21-17-19-4-5-25-17)3-2-10(13)6-14(22)16(24)20-12/h2-7,12,18H,8-9H2,1H3,(H,20,24)(H,19,21,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	580	n/a	n/a	n/a	n/a	7.6	25
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 18: 1994-9 (2008) Article DOI: 10.1016/j.bmcl.2008.01.119 BindingDB Entry DOI: 10.7270/Q2ZW1J8V
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30255 (carboline analog, 67) Show SMILES CC1CNC(=O)c2[nH]c3ccc(cc3c12)C(=O)Nc1ccc(cc1)C(N)=O Show InChI InChI=1S/C20H18N4O3/c1-10-9-22-20(27)17-16(10)14-8-12(4-7-15(14)24-17)19(26)23-13-5-2-11(3-6-13)18(21)25/h2-8,10,24H,9H2,1H3,(H2,21,25)(H,22,27)(H,23,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	620	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 17: 4664-9 (2007) Article DOI: 10.1016/j.bmcl.2007.05.101 BindingDB Entry DOI: 10.7270/Q23N21QP
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30257 (carboline analog, 69) Show SMILES CC1CNC(=O)c2[nH]c3ccc(cc3c12)C(=O)Nc1ccc(nc1)C(N)=O Show InChI InChI=1S/C19H17N5O3/c1-9-7-22-19(27)16-15(9)12-6-10(2-4-13(12)24-16)18(26)23-11-3-5-14(17(20)25)21-8-11/h2-6,8-9,24H,7H2,1H3,(H2,20,25)(H,22,27)(H,23,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	620	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 17: 4664-9 (2007) Article DOI: 10.1016/j.bmcl.2007.05.101 BindingDB Entry DOI: 10.7270/Q23N21QP
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30305 (indole-based 7-membered lactam, 25f) Show SMILES CNCC1CNC(=O)c2cc3ccc(cc3n2C1)C(=O)Nc1nccs1 Show InChI InChI=1S/C18H19N5O2S/c1-19-8-11-9-21-17(25)15-6-12-2-3-13(7-14(12)23(15)10-11)16(24)22-18-20-4-5-26-18/h2-7,11,19H,8-10H2,1H3,(H,21,25)(H,20,22,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	690	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 18: 1994-9 (2008) Article DOI: 10.1016/j.bmcl.2008.01.119 BindingDB Entry DOI: 10.7270/Q2ZW1J8V
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30258 (carboline analog, 70) Show SMILES COC(=O)c1csc(NC(=O)c2ccc3[nH]c4c(C(C)CNC4=O)c3c2)n1 Show InChI InChI=1S/C18H16N4O4S/c1-8-6-19-16(24)14-13(8)10-5-9(3-4-11(10)20-14)15(23)22-18-21-12(7-27-18)17(25)26-2/h3-5,7-8,20H,6H2,1-2H3,(H,19,24)(H,21,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	750	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 17: 4664-9 (2007) Article DOI: 10.1016/j.bmcl.2007.05.101 BindingDB Entry DOI: 10.7270/Q23N21QP
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30224 (carboline analog, 36) Show SMILES CC1CNC(=O)c2[nH]c3ccc(cc3c12)C(=O)Nc1ccncc1 Show InChI InChI=1S/C18H16N4O2/c1-10-9-20-18(24)16-15(10)13-8-11(2-3-14(13)22-16)17(23)21-12-4-6-19-7-5-12/h2-8,10,22H,9H2,1H3,(H,20,24)(H,19,21,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	760	n/a	n/a	n/a	n/a	7.6	25
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 17: 4664-9 (2007) Article DOI: 10.1016/j.bmcl.2007.05.101 BindingDB Entry DOI: 10.7270/Q23N21QP
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30256 (carboline analog, 68) Show SMILES COC(=O)c1ccc(NC(=O)c2ccc3[nH]c4c(C(C)CNC4=O)c3c2)cn1 Show InChI InChI=1S/C20H18N4O4/c1-10-8-22-19(26)17-16(10)13-7-11(3-5-14(13)24-17)18(25)23-12-4-6-15(21-9-12)20(27)28-2/h3-7,9-10,24H,8H2,1-2H3,(H,22,26)(H,23,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	760	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 17: 4664-9 (2007) Article DOI: 10.1016/j.bmcl.2007.05.101 BindingDB Entry DOI: 10.7270/Q23N21QP
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30260 (carboline analog, 72) Show SMILES COC(=O)c1cnc(NC(=O)c2ccc3[nH]c4c(C(C)CNC4=O)c3c2)s1 Show InChI InChI=1S/C18H16N4O4S/c1-8-6-19-16(24)14-13(8)10-5-9(3-4-11(10)21-14)15(23)22-18-20-7-12(27-18)17(25)26-2/h3-5,7-8,21H,6H2,1-2H3,(H,19,24)(H,20,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	770	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 17: 4664-9 (2007) Article DOI: 10.1016/j.bmcl.2007.05.101 BindingDB Entry DOI: 10.7270/Q23N21QP
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30242 (carboline analog, 54) Show SMILES CC1CNC(=O)c2[nH]c3ccc(cc3c12)C(=O)Nc1cccc(c1)C#N Show InChI InChI=1S/C20H16N4O2/c1-11-10-22-20(26)18-17(11)15-8-13(5-6-16(15)24-18)19(25)23-14-4-2-3-12(7-14)9-21/h2-8,11,24H,10H2,1H3,(H,22,26)(H,23,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	770	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 17: 4664-9 (2007) Article DOI: 10.1016/j.bmcl.2007.05.101 BindingDB Entry DOI: 10.7270/Q23N21QP
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30225 (carboline analog, 37) Show SMILES CC1CNC(=O)c2[nH]c3ccc(cc3c12)C(=O)Nc1nccs1 Show InChI InChI=1S/C16H14N4O2S/c1-8-7-18-15(22)13-12(8)10-6-9(2-3-11(10)19-13)14(21)20-16-17-4-5-23-16/h2-6,8,19H,7H2,1H3,(H,18,22)(H,17,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	820	n/a	n/a	n/a	n/a	7.6	25
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 17: 4664-9 (2007) Article DOI: 10.1016/j.bmcl.2007.05.101 BindingDB Entry DOI: 10.7270/Q23N21QP
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30253 (carboline analog, 65) Show SMILES COC(=O)c1ccc(NC(=O)c2ccc3[nH]c4c(C(C)CNC4=O)c3c2)cc1 Show InChI InChI=1S/C21H19N3O4/c1-11-10-22-20(26)18-17(11)15-9-13(5-8-16(15)24-18)19(25)23-14-6-3-12(4-7-14)21(27)28-2/h3-9,11,24H,10H2,1-2H3,(H,22,26)(H,23,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	930	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 17: 4664-9 (2007) Article DOI: 10.1016/j.bmcl.2007.05.101 BindingDB Entry DOI: 10.7270/Q23N21QP
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30280 (indole-based 6-membered lactam, 3d) Show SMILES OCC1Cc2c([nH]c3ccc(cc23)C(=O)Nc2nccs2)C(=O)N1 Show InChI InChI=1S/C16H14N4O3S/c21-7-9-6-11-10-5-8(14(22)20-16-17-3-4-24-16)1-2-12(10)19-13(11)15(23)18-9/h1-5,9,19,21H,6-7H2,(H,18,23)(H,17,20,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	7.6	25
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 18: 1994-9 (2008) Article DOI: 10.1016/j.bmcl.2008.01.119 BindingDB Entry DOI: 10.7270/Q2ZW1J8V
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30287 (indole-based 6-membered lactam, 22) Show SMILES O=C(Nc1nccs1)c1ccc2cc3C(=O)NCCn3c2c1 Show InChI InChI=1S/C15H12N4O2S/c20-13(18-15-17-4-6-22-15)10-2-1-9-7-12-14(21)16-3-5-19(12)11(9)8-10/h1-2,4,6-8H,3,5H2,(H,16,21)(H,17,18,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	7.6	25
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 18: 1994-9 (2008) Article DOI: 10.1016/j.bmcl.2008.01.119 BindingDB Entry DOI: 10.7270/Q2ZW1J8V
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30278 (indole-based 6-membered lactam, 3c) Show SMILES OCC1Cc2c([nH]c3ccc(cc23)C(=O)Nc2cccnc2)C(=O)N1 Show InChI InChI=1S/C18H16N4O3/c23-9-12-7-14-13-6-10(17(24)20-11-2-1-5-19-8-11)3-4-15(13)22-16(14)18(25)21-12/h1-6,8,12,22-23H,7,9H2,(H,20,24)(H,21,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	7.6	25
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 18: 1994-9 (2008) Article DOI: 10.1016/j.bmcl.2008.01.119 BindingDB Entry DOI: 10.7270/Q2ZW1J8V
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30286 (indole-based 6-membered lactam, 4d) Show SMILES CC1Cn2c(cc3ccc(cc23)C(=O)Nc2cccnc2)C(=O)N1 Show InChI InChI=1S/C18H16N4O2/c1-11-10-22-15-8-13(17(23)21-14-3-2-6-19-9-14)5-4-12(15)7-16(22)18(24)20-11/h2-9,11H,10H2,1H3,(H,20,24)(H,21,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	7.6	25
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 18: 1994-9 (2008) Article DOI: 10.1016/j.bmcl.2008.01.119 BindingDB Entry DOI: 10.7270/Q2ZW1J8V
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30308 (indole-based 7-membered lactam, 25i) Show SMILES CC(=O)NCC1CNC(=O)c2cc3ccc(cc3n2C1)C(=O)Nc1nccs1 Show InChI InChI=1S/C19H19N5O3S/c1-11(25)21-8-12-9-22-18(27)16-6-13-2-3-14(7-15(13)24(16)10-12)17(26)23-19-20-4-5-28-19/h2-7,12H,8-10H2,1H3,(H,21,25)(H,22,27)(H,20,23,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 18: 1994-9 (2008) Article DOI: 10.1016/j.bmcl.2008.01.119 BindingDB Entry DOI: 10.7270/Q2ZW1J8V
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30274 (carboline analog, 86) Show SMILES CC1CNC(=O)c2[nH]c3ccc(cc3c12)C(=O)Nc1ncc(s1)C(=O)NCCN(C)C Show InChI InChI=1S/C21H24N6O3S/c1-11-9-23-20(30)17-16(11)13-8-12(4-5-14(13)25-17)18(28)26-21-24-10-15(31-21)19(29)22-6-7-27(2)3/h4-5,8,10-11,25H,6-7,9H2,1-3H3,(H,22,29)(H,23,30)(H,24,26,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 17: 4664-9 (2007) Article DOI: 10.1016/j.bmcl.2007.05.101 BindingDB Entry DOI: 10.7270/Q23N21QP
					More data for this Ligand-Target Pair
MAP kinase-activated protein kinase 2 [41-364] (Homo sapiens (Human))	BDBM30240 (carboline analog, 52) Show SMILES CC1CNC(=O)c2[nH]c3ccc(cc3c12)C(=O)Nc1cccc(Cl)c1 Show InChI InChI=1S/C19H16ClN3O2/c1-10-9-21-19(25)17-16(10)14-7-11(5-6-15(14)23-17)18(24)22-13-4-2-3-12(20)8-13/h2-8,10,23H,9H2,1H3,(H,21,25)(H,22,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description Diluted compounds and activated GST-MK2 were incubated in neutravidin coated plates (Pierce) in reaction buffer containing biotinylated GST-LSP1 and ...				Bioorg Med Chem Lett 17: 4664-9 (2007) Article DOI: 10.1016/j.bmcl.2007.05.101 BindingDB Entry DOI: 10.7270/Q23N21QP
					More data for this Ligand-Target Pair

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