Compile Data Set for Download or QSAR

Found 167 hits Enz. Inhib. hit(s) with all data for entry = 2121   

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
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354726 (Preparation of N-(4-(3-(1H-indol-5-yl)-1H-pyrrolo[...) Show SMILES CC(=O)Nc1ccc(cc1)-c1cnc2[nH]cc(-c3ccc4[nH]ccc4c3)c2c1 Show InChI InChI=1S/C23H18N4O/c1-14(28)27-19-5-2-15(3-6-19)18-11-20-21(13-26-23(20)25-12-18)16-4-7-22-17(10-16)8-9-24-22/h2-13,24H,1H3,(H,25,26)(H,27,28)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354888 (Preparation of N-methyl-4-{5-[4-(4-methyl-piperazi...) Show SMILES CNC(=O)c1ccc(cc1)-c1c[nH]c2ncc(cc12)-c1ccc(CN2CCN(C)CC2)cc1 Show InChI InChI=1S/C27H29N5O/c1-28-27(33)22-9-7-21(8-10-22)25-17-30-26-24(25)15-23(16-29-26)20-5-3-19(4-6-20)18-32-13-11-31(2)12-14-32/h3-10,15-17H,11-14,18H2,1-2H3,(H,28,33)(H,29,30)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354728 (Preparation of 4-(3-(1H-indol-5-yl)-1H-pyrrolo[2,3...) Show SMILES COc1cc(ccc1N)-c1cnc2[nH]cc(-c3ccc4[nH]ccc4c3)c2c1 Show InChI InChI=1S/C22H18N4O/c1-27-21-10-13(2-4-19(21)23)16-9-17-18(12-26-22(17)25-11-16)14-3-5-20-15(8-14)6-7-24-20/h2-12,24H,23H2,1H3,(H,25,26)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354730 (Preparation of 3-(1H-indol-5-yl)-5-(2-(4-methylpip...) Show SMILES CN1CCN(CC1)c1cc(ccn1)-c1cnc2[nH]cc(-c3ccc4[nH]ccc4c3)c2c1 Show InChI InChI=1S/C25H24N6/c1-30-8-10-31(11-9-30)24-14-17(4-7-27-24)20-13-21-22(16-29-25(21)28-15-20)18-2-3-23-19(12-18)5-6-26-23/h2-7,12-16,26H,8-11H2,1H3,(H,28,29)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354731 (Preparation of 4-(3-(1H-indol-5-yl)-1H-pyrrolo[2,3...) Show SMILES Nc1ccc(cc1)-c1cnc2[nH]cc(-c3ccc4[nH]ccc4c3)c2c1 Show InChI InChI=1S/C21H16N4/c22-17-4-1-13(2-5-17)16-10-18-19(12-25-21(18)24-11-16)14-3-6-20-15(9-14)7-8-23-20/h1-12,23H,22H2,(H,24,25)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM50441568 (CHEMBL2436983 | US10485800, Example 9 | US9814704,...) Show SMILES Nc1ncc(cn1)-c1cnc2[nH]cc(-c3ccc4[nH]ccc4c3)c2c1 Show InChI InChI=1S/C19H14N6/c20-19-24-8-14(9-25-19)13-6-15-16(10-23-18(15)22-7-13)11-1-2-17-12(5-11)3-4-21-17/h1-10,21H,(H,22,23)(H2,20,24,25)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354734 (Preparation of N-(4-(3-(1H-indol-5-yl)-1H-pyrrolo[...) Show SMILES CS(=O)(=O)Nc1ccc(cc1)-c1cnc2[nH]cc(-c3ccc4[nH]ccc4c3)c2c1 Show InChI InChI=1S/C22H18N4O2S/c1-29(27,28)26-18-5-2-14(3-6-18)17-11-19-20(13-25-22(19)24-12-17)15-4-7-21-16(10-15)8-9-23-21/h2-13,23,26H,1H3,(H,24,25)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354738 (Preparation of 4-(5-(3,4,5-trimethoxyphenyl)-1H-py...) Show SMILES COc1cc(cc(OC)c1OC)-c1cnc2[nH]cc(-c3ccc(N)cc3)c2c1 Show InChI InChI=1S/C22H21N3O3/c1-26-19-9-14(10-20(27-2)21(19)28-3)15-8-17-18(12-25-22(17)24-11-15)13-4-6-16(23)7-5-13/h4-12H,23H2,1-3H3,(H,24,25)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354739 (Preparation of N-(4-(5-(3,4,5-trimethoxyphenyl)-1H...) Show SMILES COc1cc(cc(OC)c1OC)-c1cnc2[nH]cc(-c3ccc(NC(C)=O)cc3)c2c1 Show InChI InChI=1S/C24H23N3O4/c1-14(28)27-18-7-5-15(6-8-18)20-13-26-24-19(20)9-17(12-25-24)16-10-21(29-2)23(31-4)22(11-16)30-3/h5-13H,1-4H3,(H,25,26)(H,27,28)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM50441570 (CHEMBL2436976 | US10485800, Example 17 | US9814704...) Show SMILES COc1cc(cc(OC)c1OC)-c1cnc2[nH]cc(-c3cnc(N)nc3)c2c1 Show InChI InChI=1S/C20H19N5O3/c1-26-16-5-11(6-17(27-2)18(16)28-3)12-4-14-15(10-23-19(14)22-7-12)13-8-24-20(21)25-9-13/h4-10H,1-3H3,(H,22,23)(H2,21,24,25)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM50441571 (CHEMBL2436982 | US10485800, Example 18 | US9814704...) Show SMILES COc1cc(cc(OC)c1OC)-c1cnc2[nH]cc(-c3ccc(N)nc3)c2c1 Show InChI InChI=1S/C21H20N4O3/c1-26-17-7-13(8-18(27-2)20(17)28-3)14-6-15-16(11-25-21(15)24-10-14)12-4-5-19(22)23-9-12/h4-11H,1-3H3,(H2,22,23)(H,24,25)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354742 (Preparation of N,N-dimethyl-5-(5-(3,4,5-trimethoxy...) Show SMILES COc1cc(cc(OC)c1OC)-c1cnc2[nH]cc(-c3ccc(nc3)N(C)C)c2c1 Show InChI InChI=1S/C23H24N4O3/c1-27(2)21-7-6-14(11-24-21)18-13-26-23-17(18)8-16(12-25-23)15-9-19(28-3)22(30-5)20(10-15)29-4/h6-13H,1-5H3,(H,25,26)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354747 (Preparation of 3-(1-methyl-1H-indol-5-yl)-5-(3,4,5...) Show SMILES COc1cc(cc(OC)c1OC)-c1cnc2[nH]cc(-c3ccc4n(C)ccc4c3)c2c1 Show InChI InChI=1S/C25H23N3O3/c1-28-8-7-16-9-15(5-6-21(16)28)20-14-27-25-19(20)10-18(13-26-25)17-11-22(29-2)24(31-4)23(12-17)30-3/h5-14H,1-4H3,(H,26,27)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354748 (Preparation of 4-(5-(3,4,5-trimethoxyphenyl)-1H-py...) Show SMILES COc1cc(cc(OC)c1OC)-c1cnc2[nH]cc(-c3ccc(cc3)C(N)=O)c2c1 Show InChI InChI=1S/C23H21N3O4/c1-28-19-9-15(10-20(29-2)21(19)30-3)16-8-17-18(12-26-23(17)25-11-16)13-4-6-14(7-5-13)22(24)27/h4-12H,1-3H3,(H2,24,27)(H,25,26)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354749 (Preparation of 4-(5-(3,4-dimethoxyphenyl)-1H-pyrro...) Show SMILES COc1ccc(cc1OC)-c1cnc2[nH]cc(-c3ccc(cc3)C(N)=O)c2c1 Show InChI InChI=1S/C22H19N3O3/c1-27-19-8-7-15(10-20(19)28-2)16-9-17-18(12-25-22(17)24-11-16)13-3-5-14(6-4-13)21(23)26/h3-12H,1-2H3,(H2,23,26)(H,24,25)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354753 (US10485800, Example 30 | US9814704, Example 30) Show SMILES Cc1ccc(cc1)S(=O)(=O)n1cc(-c2ccc3[nH]ccc3c2)c2cc(cnc12)-c1ccc(F)nc1 Show InChI InChI=1S/C27H19FN4O2S/c1-17-2-6-22(7-3-17)35(33,34)32-16-24(18-4-8-25-19(12-18)10-11-29-25)23-13-21(15-31-27(23)32)20-5-9-26(28)30-14-20/h2-16,29H,1H3	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354755 (US9814704, Example 32) Show SMILES Cc1ccc(cc1)S(=O)(=O)n1cc(-c2ccc3[nH]ccc3c2)c2cc(cnc12)-c1ccc(C=O)cc1 Show InChI InChI=1S/C29H21N3O3S/c1-19-2-9-25(10-3-19)36(34,35)32-17-27(22-8-11-28-23(14-22)12-13-30-28)26-15-24(16-31-29(26)32)21-6-4-20(18-33)5-7-21/h2-18,30H,1H3	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354756 (Preparation of 1-(4-(3-(1H-indol-5-yl)-1H-pyrrolo[...) Show SMILES CN(C)Cc1ccc(cc1)-c1cnc2[nH]cc(-c3ccc4[nH]ccc4c3)c2c1 Show InChI InChI=1S/C24H22N4/c1-28(2)15-16-3-5-17(6-4-16)20-12-21-22(14-27-24(21)26-13-20)18-7-8-23-19(11-18)9-10-25-23/h3-14,25H,15H2,1-2H3,(H,26,27)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354757 (US9814704, Example 34) Show SMILES COc1cc(ccc1OCCN1CCNCC1)-c1cnc2n(cc(-c3ccc4[nH]ccc4c3)c2c1)S(=O)(=O)c1ccc(C)cc1 Show InChI InChI=1S/C35H35N5O4S/c1-24-3-7-29(8-4-24)45(41,42)40-23-31(26-5-9-32-27(19-26)11-12-37-32)30-20-28(22-38-35(30)40)25-6-10-33(34(21-25)43-2)44-18-17-39-15-13-36-14-16-39/h3-12,19-23,36-37H,13-18H2,1-2H3	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM356235 (BDBM50441572 | US10485800, Example 1 | US9814704, ...) Show SMILES COc1cc(cc(OC)c1OC)-c1cnc2[nH]cc(-c3ccc4[nH]ccc4c3)c2c1 Show InChI InChI=1S/C24H21N3O3/c1-28-21-10-16(11-22(29-2)23(21)30-3)17-9-18-19(13-27-24(18)26-12-17)14-4-5-20-15(8-14)6-7-25-20/h4-13,25H,1-3H3,(H,26,27)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354760 (Preparation of 2-(3,4-dimethoxyphenyl)-7-(1H-indol...) Show SMILES COc1ccc(cc1OC)-c1cnc2[nH]cc(-c3ccc4[nH]ccc4c3)c2n1 Show InChI InChI=1S/C22H18N4O2/c1-27-19-6-4-14(10-20(19)28-2)18-12-25-22-21(26-18)16(11-24-22)13-3-5-17-15(9-13)7-8-23-17/h3-12,23H,1-2H3,(H,24,25)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354761 (Preparation of 4-(7-(1H-indol-5-yl)-5H-pyrrolo[3,2...) Show SMILES COc1cc(ccc1N)-c1cnc2[nH]cc(-c3ccc4[nH]ccc4c3)c2n1 Show InChI InChI=1S/C21H17N5O/c1-27-19-9-13(2-4-16(19)22)18-11-25-21-20(26-18)15(10-24-21)12-3-5-17-14(8-12)6-7-23-17/h2-11,23H,22H2,1H3,(H,24,25)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354762 (Preparation of 4-(2-(4-(7-(1H-indol-5-yl)-5H-pyrro...) Show SMILES COc1cc(ccc1OCCN1CCOCC1)-c1cnc2[nH]cc(-c3ccc4[nH]ccc4c3)c2n1 Show InChI InChI=1S/C27H27N5O3/c1-33-25-15-19(3-5-24(25)35-13-10-32-8-11-34-12-9-32)23-17-30-27-26(31-23)21(16-29-27)18-2-4-22-20(14-18)6-7-28-22/h2-7,14-17,28H,8-13H2,1H3,(H,29,30)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM50441573 (CHEMBL2436979 | US10485800, Example 40 | US9814704...) Show SMILES COc1cc(cc(OC)c1OC)-c1cnc2[nH]c(=O)n(-c3ccc4[nH]ccc4c3)c2n1 Show InChI InChI=1S/C22H19N5O4/c1-29-17-9-13(10-18(30-2)19(17)31-3)16-11-24-20-21(25-16)27(22(28)26-20)14-4-5-15-12(8-14)6-7-23-15/h4-11,23H,1-3H3,(H,24,26,28)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354778 (6-(4-hydroxy-3- methoxyphenyl)-1-(1H- indol-5-yl)-...) Show SMILES COc1cc(ccc1O)-c1cnc2[nH]c(=O)n(-c3ccc4[nH]ccc4c3)c2n1 Show InChI InChI=1S/C20H15N5O3/c1-28-17-9-11(2-5-16(17)26)15-10-22-18-19(23-15)25(20(27)24-18)13-3-4-14-12(8-13)6-7-21-14/h2-10,21,26H,1H3,(H,22,24,27)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354780 (1-(1H-indol-5-yl)-6-(3- methoxy-4-(2- morpholinoet...) Show SMILES COc1cc(ccc1OCCN1CCOCC1)-c1cnc2[nH]c(=O)n(-c3ccc4[nH]ccc4c3)c2n1 Show InChI InChI=1S/C26H26N6O4/c1-34-23-15-17(2-5-22(23)36-13-10-31-8-11-35-12-9-31)21-16-28-24-25(29-21)32(26(33)30-24)19-3-4-20-18(14-19)6-7-27-20/h2-7,14-16,27H,8-13H2,1H3,(H,28,30,33)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354782 (6-(3,5-difluoro-4- hydroxyphenyl)-1-(1H- indol-5-y...) Show SMILES Oc1c(F)cc(cc1F)-c1cnc2[nH]c(=O)n(-c3ccc4[nH]ccc4c3)c2n1 Show InChI InChI=1S/C19H11F2N5O2/c20-12-6-10(7-13(21)16(12)27)15-8-23-17-18(24-15)26(19(28)25-17)11-1-2-14-9(5-11)3-4-22-14/h1-8,22,27H,(H,23,25,28)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354783 (6-(4-amino-3- methoxyphenyl)-1-(1H- indol-5-yl)-1H...) Show SMILES COc1cc(ccc1N)-c1cnc2[nH]c(=O)n(-c3ccc4[nH]ccc4c3)c2n1 Show InChI InChI=1S/C20H16N6O2/c1-28-17-9-11(2-4-14(17)21)16-10-23-18-19(24-16)26(20(27)25-18)13-3-5-15-12(8-13)6-7-22-15/h2-10,22H,21H2,1H3,(H,23,25,27)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354785 (6-(4-hydroxy-3,5- dimethoxyphenyl)-1-(1H- indol-5-...) Show SMILES COc1cc(cc(OC)c1O)-c1cnc2[nH]c(=O)n(-c3ccc4[nH]ccc4c3)c2n1 Show InChI InChI=1S/C21H17N5O4/c1-29-16-8-12(9-17(30-2)18(16)27)15-10-23-19-20(24-15)26(21(28)25-19)13-3-4-14-11(7-13)5-6-22-14/h3-10,22,27H,1-2H3,(H,23,25,28)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354795 (1-(2-methyl-1H-indol-5-yl)- 6-(3,4,5-trimethoxyphe...) Show SMILES COc1cc(cc(OC)c1OC)-c1cnc2[nH]c(=O)n(-c3ccc4[nH]c(C)cc4c3)c2n1 Show InChI InChI=1S/C23H21N5O4/c1-12-7-13-8-15(5-6-16(13)25-12)28-22-21(27-23(28)29)24-11-17(26-22)14-9-18(30-2)20(32-4)19(10-14)31-3/h5-11,25H,1-4H3,(H,24,27,29)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354797 (1-cyclopentyl-6-(3,4,5- trimethoxy phenyl)-1H- imi...) Show SMILES COc1cc(cc(OC)c1OC)-c1cnc2[nH]c(=O)n(C3CCCC3)c2n1 Show InChI InChI=1S/C19H22N4O4/c1-25-14-8-11(9-15(26-2)16(14)27-3)13-10-20-17-18(21-13)23(19(24)22-17)12-6-4-5-7-12/h8-10,12H,4-7H2,1-3H3,(H,20,22,24)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354825 (1-(1H-benzo[d]imidazol-5- yl)-6-(3,4,5- trimethoxy...) Show SMILES COc1cc(cc(OC)c1OC)-c1cnc2[nH]c(=O)n(-c3ccc4[nH]cnc4c3)c2n1 Show InChI InChI=1S/C21H18N6O4/c1-29-16-6-11(7-17(30-2)18(16)31-3)15-9-22-19-20(25-15)27(21(28)26-19)12-4-5-13-14(8-12)24-10-23-13/h4-10H,1-3H3,(H,23,24)(H,22,26,28)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354833 (1-(2,3-dihydro-1H-inden-2- yl)-6-(3,4,5- trimethox...) Show SMILES COc1cc(cc(OC)c1OC)-c1cnc2[nH]c(=O)n(C3Cc4ccccc4C3)c2n1 Show InChI InChI=1S/C23H22N4O4/c1-29-18-10-15(11-19(30-2)20(18)31-3)17-12-24-21-22(25-17)27(23(28)26-21)16-8-13-6-4-5-7-14(13)9-16/h4-7,10-12,16H,8-9H2,1-3H3,(H,24,26,28)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354835 (1-(1H-pyrrolo[2,3- b]pyridin-5-yl)-6-(3,4,5- trime...) Show SMILES COc1cc(cc(OC)c1OC)-c1cnc2[nH]c(=O)n(-c3cnc4[nH]ccc4c3)c2n1 Show InChI InChI=1S/C21H18N6O4/c1-29-15-7-12(8-16(30-2)17(15)31-3)14-10-24-19-20(25-14)27(21(28)26-19)13-6-11-4-5-22-18(11)23-9-13/h4-10H,1-3H3,(H,22,23)(H,24,26,28)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354836 (1-(1H-indol-6-yl)-6-(3,4,5- trimethoxyphenyl)-1H- ...) Show SMILES COc1cc(cc(OC)c1OC)-c1cnc2[nH]c(=O)n(-c3ccc4cc[nH]c4c3)c2n1 Show InChI InChI=1S/C22H19N5O4/c1-29-17-8-13(9-18(30-2)19(17)31-3)16-11-24-20-21(25-16)27(22(28)26-20)14-5-4-12-6-7-23-15(12)10-14/h4-11,23H,1-3H3,(H,24,26,28)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354864 (Preparation of 4-{4-[3-(1H-indol-5-yl)-1H-pyrrolo[...) Show SMILES CN1CCN(Cc2ccc(cc2)-c2cnc3[nH]cc(-c4ccc5[nH]ccc5c4)c3c2)CC1=O Show InChI InChI=1S/C27H25N5O/c1-31-10-11-32(17-26(31)33)16-18-2-4-19(5-3-18)22-13-23-24(15-30-27(23)29-14-22)20-6-7-25-21(12-20)8-9-28-25/h2-9,12-15,28H,10-11,16-17H2,1H3,(H,29,30)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354865 (Preparation of 4-{4-[3-(1H-indol-5-yl)-1H-pyrrolo[...) Show SMILES O=C1CN(Cc2ccc(cc2)-c2cnc3[nH]cc(-c4ccc5[nH]ccc5c4)c3c2)CCN1 Show InChI InChI=1S/C26H23N5O/c32-25-16-31(10-9-28-25)15-17-1-3-18(4-2-17)21-12-22-23(14-30-26(22)29-13-21)19-5-6-24-20(11-19)7-8-27-24/h1-8,11-14,27H,9-10,15-16H2,(H,28,32)(H,29,30)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354866 (Preparation of 4-{3-[3-(1H-indol-5-yl)-1H-pyrrolo[...) Show SMILES CN1CCN(Cc2cccc(c2)-c2cnc3[nH]cc(-c4ccc5[nH]ccc5c4)c3c2)CC1=O Show InChI InChI=1S/C27H25N5O/c1-31-9-10-32(17-26(31)33)16-18-3-2-4-19(11-18)22-13-23-24(15-30-27(23)29-14-22)20-5-6-25-21(12-20)7-8-28-25/h2-8,11-15,28H,9-10,16-17H2,1H3,(H,29,30)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354867 (Preparation of 4-{4-[3-(1H-indol-5-yl)-1H-pyrrolo[...) Show SMILES CC(C)(C)OC(=O)N1CCN(Cc2ccc(cc2)-c2cnc3[nH]cc(-c4ccc5[nH]ccc5c4)c3c2)CC1 Show InChI InChI=1S/C31H33N5O2/c1-31(2,3)38-30(37)36-14-12-35(13-15-36)20-21-4-6-22(7-5-21)25-17-26-27(19-34-29(26)33-18-25)23-8-9-28-24(16-23)10-11-32-28/h4-11,16-19,32H,12-15,20H2,1-3H3,(H,33,34)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354869 (Preparation of 1-(4-{4-[3-(1H-indol-5-yl)-1H-pyrro...) Show SMILES CC(=O)N1CCN(CC1)C(=O)c1ccc(cc1)-c1cnc2[nH]cc(-c3ccc4[nH]ccc4c3)c2c1 Show InChI InChI=1S/C28H25N5O2/c1-18(34)32-10-12-33(13-11-32)28(35)20-4-2-19(3-5-20)23-15-24-25(17-31-27(24)30-16-23)21-6-7-26-22(14-21)8-9-29-26/h2-9,14-17,29H,10-13H2,1H3,(H,30,31)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354870 (Preparation of {3-[3-(1H-indol-5-yl)-1H-pyrrolo[2,...) Show SMILES CN1CCN(CC1)C(=O)c1cccc(c1)-c1cnc2[nH]cc(-c3ccc4[nH]ccc4c3)c2c1 Show InChI InChI=1S/C27H25N5O/c1-31-9-11-32(12-10-31)27(33)21-4-2-3-18(13-21)22-15-23-24(17-30-26(23)29-16-22)19-5-6-25-20(14-19)7-8-28-25/h2-8,13-17,28H,9-12H2,1H3,(H,29,30)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354871 (US10485800, Example 148 | US9814704, Example 148) Show SMILES CC(C)(C)OC(=O)N1CCN(CC1)C(=O)c1ccc(cc1)-c1cnc2[nH]cc(-c3ccc(cc3)C(N)=O)c2c1 Show InChI InChI=1S/C30H31N5O4/c1-30(2,3)39-29(38)35-14-12-34(13-15-35)28(37)22-10-4-19(5-11-22)23-16-24-25(18-33-27(24)32-17-23)20-6-8-21(9-7-20)26(31)36/h4-11,16-18H,12-15H2,1-3H3,(H2,31,36)(H,32,33)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354872 (Preparation of 4-{5-[4-(piperazine-1-carbonyl)-phe...) Show SMILES NC(=O)c1ccc(cc1)-c1c[nH]c2ncc(cc12)-c1ccc(cc1)C(=O)N1CC[NH2+]CC1 Show InChI InChI=1S/C25H23N5O2/c26-23(31)18-5-3-17(4-6-18)22-15-29-24-21(22)13-20(14-28-24)16-1-7-19(8-2-16)25(32)30-11-9-27-10-12-30/h1-8,13-15,27H,9-12H2,(H2,26,31)(H,28,29)/p+1	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354874 (Preparation of 4-{3-[3-(4-carbamoyl-phenyl)-1H-pyr...) Show SMILES CC(C)(C)OC(=O)N1CCN(CC1)C(=O)c1cccc(c1)-c1cnc2[nH]cc(-c3ccc(cc3)C(N)=O)c2c1 Show InChI InChI=1S/C30H31N5O4/c1-30(2,3)39-29(38)35-13-11-34(12-14-35)28(37)22-6-4-5-21(15-22)23-16-24-25(18-33-27(24)32-17-23)19-7-9-20(10-8-19)26(31)36/h4-10,15-18H,11-14H2,1-3H3,(H2,31,36)(H,32,33)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354879 (Preparation of 4-{5-[3-(4-methyl-piperazin-1-ylmet...) Show SMILES CN1CCN(Cc2cccc(c2)-c2cnc3[nH]cc(-c4ccc(cc4)C(N)=O)c3c2)CC1 Show InChI InChI=1S/C26H27N5O/c1-30-9-11-31(12-10-30)17-18-3-2-4-21(13-18)22-14-23-24(16-29-26(23)28-15-22)19-5-7-20(8-6-19)25(27)32/h2-8,13-16H,9-12,17H2,1H3,(H2,27,32)(H,28,29)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354880 (Preparation of 4-{5-[4-(4-acetyl-piperazin-1-ylmet...) Show SMILES CC(=O)N1CCN(Cc2ccc(cc2)-c2cnc3[nH]cc(-c4ccc(cc4)C(N)=O)c3c2)CC1 Show InChI InChI=1S/C27H27N5O2/c1-18(33)32-12-10-31(11-13-32)17-19-2-4-20(5-3-19)23-14-24-25(16-30-27(24)29-15-23)21-6-8-22(9-7-21)26(28)34/h2-9,14-16H,10-13,17H2,1H3,(H2,28,34)(H,29,30)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354881 (Preparation of 4-{5-[4-(4-methyl-3-oxo-piperazin-1...) Show SMILES CN1CCN(Cc2ccc(cc2)-c2cnc3[nH]cc(-c4ccc(cc4)C(N)=O)c3c2)CC1=O Show InChI InChI=1S/C26H25N5O2/c1-30-10-11-31(16-24(30)32)15-17-2-4-18(5-3-17)21-12-22-23(14-29-26(22)28-13-21)19-6-8-20(9-7-19)25(27)33/h2-9,12-14H,10-11,15-16H2,1H3,(H2,27,33)(H,28,29)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354882 (US9814704, Example 159) Show SMILES CC(=O)NCc1ccc(cc1)-c1cn(c2ncc(Br)cc12)S(=O)(=O)c1ccc(C)cc1 Show InChI InChI=1S/C23H20BrN3O3S/c1-15-3-9-20(10-4-15)31(29,30)27-14-22(21-11-19(24)13-26-23(21)27)18-7-5-17(6-8-18)12-25-16(2)28/h3-11,13-14H,12H2,1-2H3,(H,25,28)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM354885 (US9814704, Example 162) Show SMILES CN1CCN(Cc2ccc(cc2)-c2cnc3ncc(cc23)-c2ccc(cc2)C(N)=O)CC1 Show InChI	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 11 (Homo sapiens (Human))	BDBM50441569 (CHEMBL2436981 | US10485800, Example 4 | US9814704,...) Show SMILES Nc1ccc(cn1)-c1cnc2[nH]cc(-c3ccc4[nH]ccc4c3)c2c1 Show InChI InChI=1S/C20H15N5/c21-19-4-2-14(9-23-19)15-8-16-17(11-25-20(16)24-10-15)12-1-3-18-13(7-12)5-6-22-18/h1-11,22H,(H2,21,23)(H,24,25)	PDB NCI pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
The University of Rochester US Patent					Assay Description 200 ng (130 nM) MLK3 (Dundee, DU8313) was incubated with 1 μM inactive MKK7b (Dundee, DU703) in the presence of 2 μM cold ATP (Km) and 0.5 ...				US Patent US9814704 (2017) BindingDB Entry DOI: 10.7270/Q27H1MRN
					More data for this Ligand-Target Pair

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