Found 20 hits Enz. Inhib. hit(s) with all data for entry = 7963 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 kinase 4
(Homo sapiens (Human)) | BDBM225885
(MAP02)Show SMILES CN1CCN(CC1)c1ccc(cc1)-c1cnc2[nH]c3c(C)nc(nc3c2c1)-c1cnn(C)c1 Show InChI InChI=1S/C25H26N8/c1-16-22-23(30-24(28-16)19-14-27-32(3)15-19)21-12-18(13-26-25(21)29-22)17-4-6-20(7-5-17)33-10-8-31(2)9-11-33/h4-7,12-15H,8-11H2,1-3H3,(H,26,29) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| Purchase
MCE PC cid PC sid UniChem
| D3R
| 2.20 | n/a | 5.84 | n/a | n/a | n/a | n/a | n/a | n/a |
D3R
| Assay Description Z'Lyte Assay |
D3R 409: (2016)
BindingDB Entry DOI: 10.7270/Q2R49PN1 |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 4
(Homo sapiens (Human)) | BDBM225901
(MAP19 | US9855269, Compound 342)Show InChI InChI=1S/C17H14N6/c1-10-8-21-23-15(10)12-4-2-3-11(7-12)13-5-6-14-16(22-13)17(18)20-9-19-14/h2-9H,1H3,(H,21,23)(H2,18,19,20) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| PC cid PC sid UniChem
| D3R
| 3.66 | n/a | 3.11 | n/a | n/a | n/a | n/a | n/a | n/a |
D3R
| Assay Description Z'Lyte Assay |
D3R 409: (2016)
BindingDB Entry DOI: 10.7270/Q2R49PN1 |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 4
(Homo sapiens (Human)) | BDBM225893
(MAP12)Show SMILES CNC(=O)c1ccc2-c3sc(cc3CCOc2c1)-c1ccnn1-c1ccc(F)cc1F Show InChI InChI=1S/C23H17F2N3O2S/c1-26-23(29)14-2-4-16-20(10-14)30-9-7-13-11-21(31-22(13)16)19-6-8-27-28(19)18-5-3-15(24)12-17(18)25/h2-6,8,10-12H,7,9H2,1H3,(H,26,29) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| PC cid PC sid UniChem
| D3R
| 4.61 | n/a | 3.88 | n/a | n/a | n/a | n/a | n/a | n/a |
D3R
| Assay Description Z'Lyte Assay |
D3R 409: (2016)
BindingDB Entry DOI: 10.7270/Q2R49PN1 |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 4
(Homo sapiens (Human)) | BDBM225889
(MAP07)Show InChI InChI=1S/C17H14ClN3O/c18-13-4-2-1-3-12(13)14-7-11-8-16(19-9-15(11)20-14)21-17(22)10-5-6-10/h1-4,7-10,20H,5-6H2,(H,19,21,22) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| PC cid PC sid UniChem
| D3R
| 7.79 | n/a | 5.94 | n/a | n/a | n/a | n/a | n/a | n/a |
D3R
| Assay Description Z'Lyte Assay |
D3R 409: (2016)
BindingDB Entry DOI: 10.7270/Q2R49PN1 |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 4
(Homo sapiens (Human)) | BDBM225896
(MAP15 | US9592235, Example 272 | US9855269, Compou...) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| PC cid PC sid PDB UniChem
| PDB D3R
| 10.7 | n/a | 12.1 | n/a | n/a | n/a | n/a | n/a | n/a |
D3R
| Assay Description Z'Lyte Assay |
D3R 409: (2016)
BindingDB Entry DOI: 10.7270/Q2R49PN1 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Mitogen-activated protein kinase kinase kinase kinase 4
(Homo sapiens (Human)) | BDBM225896
(MAP15 | US9592235, Example 272 | US9855269, Compou...) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| PC cid PC sid PDB UniChem
| PDB D3R
| 10.7 | n/a | 12.1 | n/a | n/a | n/a | n/a | n/a | n/a |
D3R
| Assay Description Z'Lyte Assay |
D3R 409: (2016)
BindingDB Entry DOI: 10.7270/Q2R49PN1 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Mitogen-activated protein kinase kinase kinase kinase 4
(Homo sapiens (Human)) | BDBM225887
(DT2012-0355237, MAP05)Show InChI InChI=1S/C18H13ClN2O3/c19-12-5-3-4-11(10-12)15-8-9-16(24-15)18(23)21-14-7-2-1-6-13(14)17(20)22/h1-10H,(H2,20,22)(H,21,23) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| Purchase
PC cid PC sid UniChem
| D3R
| 13.6 | n/a | 10.2 | n/a | n/a | n/a | n/a | n/a | n/a |
D3R
| Assay Description Z'Lyte Assay |
D3R 409: (2016)
BindingDB Entry DOI: 10.7270/Q2R49PN1 |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 4
(Homo sapiens (Human)) | BDBM225891
(MAP09)Show SMILES FC(F)(F)Cn1c(cc2cc(NC(=O)C3CC3)ncc12)-c1ccccc1Cl Show InChI InChI=1S/C19H15ClF3N3O/c20-14-4-2-1-3-13(14)15-7-12-8-17(25-18(27)11-5-6-11)24-9-16(12)26(15)10-19(21,22)23/h1-4,7-9,11H,5-6,10H2,(H,24,25,27) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| PC cid PC sid UniChem
| D3R
| 32.5 | n/a | 21.5 | n/a | n/a | n/a | n/a | n/a | n/a |
D3R
| Assay Description Z'Lyte Assay |
D3R 409: (2016)
BindingDB Entry DOI: 10.7270/Q2R49PN1 |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 4
(Homo sapiens (Human)) | BDBM225895
(MAP14 | US9592235, Example 192 | US9855269, Compou...)Show SMILES CN(C)CCC(=O)Nc1cc(F)cc(c1)-c1ccc2ncnc(N)c2c1 Show InChI InChI=1S/C19H20FN5O/c1-25(2)6-5-18(26)24-15-8-13(7-14(20)10-15)12-3-4-17-16(9-12)19(21)23-11-22-17/h3-4,7-11H,5-6H2,1-2H3,(H,24,26)(H2,21,22,23) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| PC cid PC sid UniChem
| D3R
| 75.5 | n/a | 88.4 | n/a | n/a | n/a | n/a | n/a | n/a |
D3R
| Assay Description Z'Lyte Assay |
D3R 409: (2016)
BindingDB Entry DOI: 10.7270/Q2R49PN1 |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 4
(Homo sapiens (Human)) | BDBM225898
(MAP16 | US9592235, Example 248 | US9855269, Compou...)Show InChI InChI=1S/C17H18N6/c18-17-16-14(20-11-21-17)4-5-15(22-16)23-8-6-12(10-23)9-13-3-1-2-7-19-13/h1-5,7,11-12H,6,8-10H2,(H2,18,20,21) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| PC cid PC sid UniChem
| D3R
| 78.3 | n/a | 65.7 | n/a | n/a | n/a | n/a | n/a | n/a |
D3R
| Assay Description Z'Lyte Assay |
D3R 409: (2016)
BindingDB Entry DOI: 10.7270/Q2R49PN1 |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 4
(Homo sapiens (Human)) | BDBM225890
(MAP08)Show InChI InChI=1S/C18H16ClN3O/c1-22-15-9-17(21-18(23)11-6-7-11)20-10-12(15)8-16(22)13-4-2-3-5-14(13)19/h2-5,8-11H,6-7H2,1H3,(H,20,21,23) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| PC cid PC sid UniChem
| D3R
| 95.4 | n/a | 101 | n/a | n/a | n/a | n/a | n/a | n/a |
D3R
| Assay Description Z'Lyte Assay |
D3R 409: (2016)
BindingDB Entry DOI: 10.7270/Q2R49PN1 |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 4
(Homo sapiens (Human)) | BDBM50011564
(CHEMBL3262583 | MAP10 | US9592235, Example 158 | U...)Show InChI InChI=1S/C14H10ClN3/c15-11-3-1-2-9(6-11)10-4-5-13-12(7-10)14(16)18-8-17-13/h1-8H,(H2,16,17,18) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid PDB UniChem
Similars
| PDB D3R
| 108 | n/a | 92.7 | n/a | n/a | n/a | n/a | n/a | n/a |
D3R
| Assay Description Z'Lyte Assay |
D3R 409: (2016)
BindingDB Entry DOI: 10.7270/Q2R49PN1 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Mitogen-activated protein kinase kinase kinase kinase 4
(Homo sapiens (Human)) | BDBM225888
(MAP06)Show InChI InChI=1S/C16H15ClN2O2/c1-10(20)19-9-14-7-12-6-13(17)8-15(16(12)21-14)11-2-4-18-5-3-11/h2-6,8,14H,7,9H2,1H3,(H,19,20) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| PC cid PC sid UniChem
| D3R
| 109 | n/a | 76.8 | n/a | n/a | n/a | n/a | n/a | n/a |
D3R
| Assay Description Z'Lyte Assay |
D3R 409: (2016)
BindingDB Entry DOI: 10.7270/Q2R49PN1 |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 4
(Homo sapiens (Human)) | BDBM225900
(MAP18)Show SMILES Nc1ncc(C(=O)N[C@H]2CCC[C@@H](O)C2)c2ccc(cc12)-c1cccc(F)c1 Show InChI InChI=1S/C22H22FN3O2/c23-15-4-1-3-13(9-15)14-7-8-18-19(10-14)21(24)25-12-20(18)22(28)26-16-5-2-6-17(27)11-16/h1,3-4,7-10,12,16-17,27H,2,5-6,11H2,(H2,24,25)(H,26,28)/t16-,17+/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| PC cid PC sid UniChem
| D3R
| 148 | n/a | 139 | n/a | n/a | n/a | n/a | n/a | n/a |
D3R
| Assay Description Z'Lyte Assay |
D3R 409: (2016)
BindingDB Entry DOI: 10.7270/Q2R49PN1 |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 4
(Homo sapiens (Human)) | BDBM225894
(MAP13)Show SMILES CNC(=O)c1ccc2-c3cc(nn3CCOc2c1)-c1ncnn1-c1ccc(F)cc1F Show InChI InChI=1S/C21H16F2N6O2/c1-24-21(30)12-2-4-14-18-10-16(27-28(18)6-7-31-19(14)8-12)20-25-11-26-29(20)17-5-3-13(22)9-15(17)23/h2-5,8-11H,6-7H2,1H3,(H,24,30) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| PC cid PC sid UniChem
| D3R
| 2.55E+3 | n/a | 1.74E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
D3R
| Assay Description Z'Lyte Assay |
D3R 409: (2016)
BindingDB Entry DOI: 10.7270/Q2R49PN1 |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 4
(Homo sapiens (Human)) | BDBM225899
(MAP17)Show SMILES CNC(=O)c1ccc2-c3c(C)c(nn3CCOc2c1)-c1ncnn1-c1ccc(F)cc1F Show InChI InChI=1S/C22H18F2N6O2/c1-12-19(21-26-11-27-30(21)17-6-4-14(23)10-16(17)24)28-29-7-8-32-18-9-13(22(31)25-2)3-5-15(18)20(12)29/h3-6,9-11H,7-8H2,1-2H3,(H,25,31) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| PC cid PC sid UniChem
| D3R
| 6.50E+3 | n/a | 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
D3R
| Assay Description Z'Lyte Assay |
D3R 409: (2016)
BindingDB Entry DOI: 10.7270/Q2R49PN1 |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 4
(Homo sapiens (Human)) | BDBM225884
(MAP01)Show SMILES COc1cc(ccc1O)-c1cnc(Nc2ccc(cc2)N2CCN(C)CC2)c2nccn12 Show InChI InChI=1S/C24H26N6O2/c1-28-11-13-29(14-12-28)19-6-4-18(5-7-19)27-23-24-25-9-10-30(24)20(16-26-23)17-3-8-21(31)22(15-17)32-2/h3-10,15-16,31H,11-14H2,1-2H3,(H,26,27) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| PC cid PC sid UniChem
| D3R
| n/a | n/a | 3.79 | n/a | n/a | n/a | n/a | n/a | n/a |
D3R
| Assay Description Z'Lyte Assay |
D3R 409: (2016)
BindingDB Entry DOI: 10.7270/Q2R49PN1 |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 4
(Homo sapiens (Human)) | BDBM225892
(MAP11)Show InChI InChI=1S/C18H12N6/c19-10-13-2-1-3-14(8-13)15-9-17-18(21-12-22-24(17)11-15)23-16-4-6-20-7-5-16/h1-9,11-12H,(H,20,21,22,23) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| PC cid PC sid UniChem
| D3R
| n/a | n/a | 22.5 | n/a | n/a | n/a | n/a | n/a | n/a |
D3R
| Assay Description Z'Lyte Assay |
D3R 409: (2016)
BindingDB Entry DOI: 10.7270/Q2R49PN1 |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 4
(Homo sapiens (Human)) | BDBM225886
(MAP04)Show InChI InChI=1S/C10H9N3S/c1-5-3-6(2)13-10-8(5)9(12)7(4-11)14-10/h3H,12H2,1-2H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| Purchase
PC cid PC sid UniChem
| D3R
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
D3R
| Assay Description Z'Lyte Assay |
D3R 409: (2016)
BindingDB Entry DOI: 10.7270/Q2R49PN1 |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 4
(Homo sapiens (Human)) | BDBM50354357
(CHEMBL1836471 | DT2000-0142665, MAP03)Show InChI InChI=1S/C10H11N3S/c11-9-8-6-3-1-2-4-7(6)14-10(8)13-5-12-9/h5H,1-4H2,(H2,11,12,13) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Similars
| D3R
| n/a | n/a | 2.25E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
D3R
| Assay Description Z'Lyte Assay |
D3R 409: (2016)
BindingDB Entry DOI: 10.7270/Q2R49PN1 |
More data for this Ligand-Target Pair | |