Found 1498 hits with Last Name = 'gazzard' and Initial = 'lj' 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 1
(Homo sapiens (Human)) | BDBM598177
((1s,3s)-3-Methoxy-3-methylcyclobutyl | US11612606,...)Show SMILES CO[C@]1(C)C[C@@H](C1)OC(=O)Nc1cc2cc(c(F)c(N)c2cn1)-c1cnc2OCCNc2c1C |r,wU:5.7,2.1,wD:2.2,(-6.79,-5.5,;-7.56,-4.17,;-6.79,-2.84,;-6.02,-4.17,;-5.7,-1.75,;-6.79,-.66,;-7.88,-1.75,;-6.79,.88,;-5.46,1.65,;-5.46,3.19,;-4.12,.88,;-2.79,1.65,;-1.46,.88,;-.12,1.65,;1.21,.88,;2.55,1.65,;2.55,3.19,;3.88,3.96,;1.21,3.96,;1.21,5.5,;-.12,3.19,;-1.46,3.96,;-2.79,3.19,;3.88,.88,;5.21,1.65,;6.55,.88,;6.55,-.66,;7.88,-1.43,;7.88,-2.97,;6.55,-3.74,;5.21,-2.97,;5.21,-1.43,;3.88,-.66,;2.55,-1.43,)| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598189
(US11612606, Compound 535a | trans-2-Cyanocyclobuty...)Show SMILES Cc1c2NCCOc2ncc1-c1cc2cc(NC(=O)OC3CCC3C#N)ncc2c(N)c1F | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598191
((1r,3s)-3-(Cyanomethyl)cyclobutyl(8- | US11612606,...)Show SMILES Cc1c2NCCOc2ncc1-c1cc2cc(NC(=O)O[C@@H]3C[C@H](CC#N)C3)ncc2c(N)c1F |r,wD:20.21,22.24,(2.55,-1.22,;3.88,-.45,;5.21,-1.22,;5.21,-2.76,;6.55,-3.53,;7.88,-2.76,;7.88,-1.22,;6.55,-.45,;6.55,1.09,;5.21,1.86,;3.88,1.09,;2.55,1.86,;1.21,1.09,;-.12,1.86,;-1.46,1.09,;-2.79,1.86,;-4.12,1.09,;-5.46,1.86,;-5.46,3.4,;-6.79,1.09,;-6.79,-.45,;-5.7,-1.54,;-6.79,-2.63,;-6.79,-4.17,;-5.46,-4.94,;-4.12,-5.71,;-7.88,-1.54,;-2.79,3.4,;-1.46,4.17,;-.12,3.4,;1.21,4.17,;1.21,5.71,;2.55,3.4,;3.88,4.17,)| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598192
((1s,3r)-3-(Cyanomethyl)cyclobutyl(8- amino-7-fluor...)Show SMILES Cc1c2NCCOc2ncc1-c1cc2cc(NC(=O)O[C@@H]3C[C@H](CC#N)C3)ncc2c(N)c1F |r,wU:20.21,22.24,(2.55,-1.22,;3.88,-.45,;5.21,-1.22,;5.21,-2.76,;6.55,-3.53,;7.88,-2.76,;7.88,-1.22,;6.55,-.45,;6.55,1.09,;5.21,1.86,;3.88,1.09,;2.55,1.86,;1.21,1.09,;-.12,1.86,;-1.46,1.09,;-2.79,1.86,;-4.12,1.09,;-5.46,1.86,;-5.46,3.4,;-6.79,1.09,;-6.79,-.45,;-7.88,-1.54,;-6.79,-2.63,;-6.79,-4.17,;-5.46,-4.94,;-4.12,-5.71,;-5.7,-1.54,;-2.79,3.4,;-1.46,4.17,;-.12,3.4,;1.21,4.17,;1.21,5.71,;2.55,3.4,;3.88,4.17,)| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598194
((1r,3r)-3-Cyano-3-methylcyclobutyl(8- amino-7-fluo...)Show SMILES Cc1c2NCCOc2ncc1-c1cc2cc(NC(=O)O[C@H]3C[C@](C)(C3)C#N)ncc2c(N)c1F |r,wU:22.24,wD:20.21,22.27,(2.55,-1.43,;3.88,-.66,;5.21,-1.43,;5.21,-2.97,;6.55,-3.74,;7.88,-2.97,;7.88,-1.43,;6.55,-.66,;6.55,.88,;5.21,1.65,;3.88,.88,;2.55,1.65,;1.21,.88,;-.12,1.65,;-1.46,.88,;-2.79,1.65,;-4.12,.88,;-5.46,1.65,;-5.46,3.19,;-6.79,.88,;-6.79,-.66,;-7.88,-1.75,;-6.79,-2.84,;-7.56,-4.17,;-5.7,-1.75,;-6.02,-4.17,;-5.25,-5.5,;-2.79,3.19,;-1.46,3.96,;-.12,3.19,;1.21,3.96,;1.21,5.5,;2.55,3.19,;3.88,3.96,)| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598197
((1r,3r)-3-(Methylamino)cyclobutyl(8- | US11612606,...)Show SMILES CN[C@H]1C[C@@H](C1)OC(=O)Nc1cc2cc(c(F)c(NC(=O)OC(C)(C)C)c2cn1)-c1cnc2OCCNc2c1C |r,wU:4.6,wD:2.1,(-5.46,-7.63,;-6.79,-6.86,;-6.79,-5.32,;-5.7,-4.24,;-6.79,-3.15,;-7.88,-4.24,;-6.79,-1.61,;-5.46,-.84,;-5.46,.7,;-4.12,-1.61,;-2.79,-.84,;-1.46,-1.61,;-.12,-.84,;1.21,-1.61,;2.54,-.84,;2.54,.7,;3.88,1.47,;1.21,1.47,;1.21,3.01,;-.12,3.78,;-.12,5.32,;-1.46,3.01,;-2.79,3.78,;-2.02,5.12,;-3.56,2.45,;-4.12,4.55,;-.12,.7,;-1.46,1.47,;-2.79,.7,;3.88,-1.61,;5.21,-.84,;6.55,-1.61,;6.55,-3.15,;7.88,-3.92,;7.88,-5.46,;6.55,-6.23,;5.21,-5.46,;5.21,-3.92,;3.88,-3.15,;2.55,-3.92,)| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598103
(US11612606, Compound 452d | amino-7-fluoro-6-(8-me...)Show SMILES CN1C[C@@H](F)[C@H](C1)OC(=O)Nc1cc2cc(c(F)c(N)c2cn1)-c1cnc2OCCNc2c1C |r| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598111
(US11612606, Compound 467d | azaspiro[4.4]nonan-3-y...)Show SMILES CN1CC[C@@]2(C[C@@H](CO2)OC(=O)Nc2cc3cc(c(F)c(N)c3cn2)-c2cnc3OCCNc3c2C)C1 |r| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598119
(US11612606, Compound 478b | amino-7-fluoro-6-(8-me...)Show SMILES CCN1C[C@H](CC1=O)OC(=O)Nc1cc2cc(c(F)c(N)c2cn1)-c1cnc2OCCNc2c1C |r| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598122
(US11612606, Compound 479b | amino-7-fluoro-6-(8-me...)Show SMILES CC(C)N1C[C@H](CC1=O)OC(=O)Nc1cc2cc(c(F)c(N)c2cn1)-c1cnc2OCCNc2c1C |r| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598127
((trans)-2-Cyanocyclopentyl(8-amino-7- | US11612606...)Show SMILES Cc1c2NCCOc2ncc1-c1cc2cc(NC(=O)O[C@H]3CCCC3C#N)ncc2c(N)c1F |r| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598128
(US11612606, Compound 482b | fluoro-6-(8-methyl-2,3...)Show SMILES Cc1c2NCCOc2ncc1-c1cc2cc(NC(=O)O[C@@H]3CCCC3C#N)ncc2c(N)c1F |r| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598129
((1s,3s)-3-cyanocyclobutyl (8-amino-7- | US11612606...)Show SMILES Cc1c2NCCCc2ncc1-c1cc2cc(NC(=O)O[C@H]3C[C@H](C3)C#N)ncc2c(N)c1F |r,wU:20.21,22.26,(1.88,-.07,;3.21,.7,;4.55,-.07,;4.55,-1.61,;5.88,-2.38,;7.21,-1.61,;7.21,-.07,;5.88,.7,;5.88,2.24,;4.55,3.01,;3.21,2.24,;1.88,3.01,;.54,2.24,;-.79,3.01,;-2.12,2.24,;-3.46,3.01,;-4.79,2.24,;-4.79,.7,;-3.46,-.07,;-6.12,-.07,;-6.12,-1.61,;-5.03,-2.69,;-6.12,-3.78,;-7.21,-2.69,;-6.12,-5.32,;-6.12,-6.86,;-3.46,4.55,;-2.12,5.32,;-.79,4.55,;.54,5.32,;.54,6.86,;1.88,4.55,;3.21,5.32,)| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598130
((1s,3s)-3-Cyanocyclobutyl(8-amino-7- | US11612606,...)Show SMILES Cc1c2NCCOc2ncc1-c1cc2cc(NC(=O)O[C@H]3C[C@H](C3)C#N)ncc2c(N)c1F |r,wU:20.21,22.26,(4.28,-2.31,;5.61,-1.54,;6.94,-2.31,;6.94,-3.85,;8.28,-4.62,;9.61,-3.85,;9.61,-2.31,;8.28,-1.54,;8.28,,;6.94,.77,;5.61,,;4.28,.77,;2.94,,;1.61,.77,;.28,,;-1.06,.77,;-2.39,,;-2.39,-1.54,;-1.06,-2.31,;-3.72,-2.31,;-5.06,-1.54,;-6.55,-1.94,;-6.94,-.45,;-5.46,-.05,;-8.28,.32,;-9.61,1.09,;-1.06,2.31,;.28,3.08,;1.61,2.31,;2.94,3.08,;2.94,4.62,;4.28,2.31,;5.61,3.08,)| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598132
((1s,3s)-3-Hydroxycyclobutyl(8-amino-7- | US1161260...)Show SMILES Cc1c2NCCOc2ncc1-c1cc2cc(NC(=O)O[C@@H]3C[C@H](O)C3)ncc2c(N)c1F |r,wU:20.21,22.24,(1.88,-.84,;3.21,-.07,;4.55,-.84,;4.55,-2.38,;5.88,-3.15,;7.21,-2.38,;7.21,-.84,;5.88,-.07,;5.88,1.47,;4.55,2.24,;3.21,1.47,;1.88,2.24,;.54,1.47,;-.79,2.24,;-2.12,1.47,;-3.46,2.24,;-4.79,1.47,;-4.79,-.07,;-3.46,-.84,;-6.12,-.84,;-6.12,-2.38,;-7.21,-3.47,;-6.12,-4.55,;-6.12,-6.09,;-5.03,-3.47,;-3.46,3.78,;-2.12,4.55,;-.79,3.78,;.54,4.55,;.54,6.09,;1.88,3.78,;3.21,4.55,)| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598133
((1r,3r)-3-Hydroxycyclobutyl(8-amino-7- | US1161260...)Show SMILES Cc1c2NCCOc2ncc1-c1cc2cc(NC(=O)O[C@@H]3C[C@H](O)C3)ncc2c(N)c1F |r,wD:20.21,22.24,(1.88,-.84,;3.21,-.07,;4.55,-.84,;4.55,-2.38,;5.88,-3.15,;7.21,-2.38,;7.21,-.84,;5.88,-.07,;5.88,1.47,;4.55,2.24,;3.21,1.47,;1.88,2.24,;.54,1.47,;-.79,2.24,;-2.12,1.47,;-3.46,2.24,;-4.79,1.47,;-4.79,-.07,;-3.46,-.84,;-6.12,-.84,;-6.12,-2.38,;-5.03,-3.47,;-6.12,-4.55,;-6.12,-6.09,;-7.21,-3.47,;-3.46,3.78,;-2.12,4.55,;-.79,3.78,;.54,4.55,;.54,6.09,;1.88,3.78,;3.21,4.55,)| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598134
(3-Hydroxy-3-methylcyclobutyl(8-amino- 7-fluoro-6-(...)Show SMILES Cc1c2NCCOc2ncc1-c1cc2cc(NC(=O)OC3CC(C)(O)C3)ncc2c(N)c1F |(2.55,-2.09,;3.88,-1.32,;5.21,-2.09,;5.21,-3.63,;6.55,-4.4,;7.88,-3.63,;7.88,-2.09,;6.55,-1.32,;6.55,.22,;5.21,.99,;3.88,.22,;2.55,.99,;1.21,.22,;-.12,.99,;-1.46,.22,;-2.79,.99,;-4.12,.22,;-5.46,.99,;-5.46,2.53,;-6.79,.22,;-6.79,-1.32,;-7.88,-2.41,;-6.79,-3.5,;-7.56,-4.84,;-6.02,-4.84,;-5.7,-2.41,;-2.79,2.53,;-1.46,3.3,;-.12,2.53,;1.21,3.3,;1.21,4.84,;2.55,2.53,;3.88,3.3,)| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598316
(1-(8-Amino-7-fluoro-6-(8-methyl-2,3-dihydro-1H-pyr...)Show SMILES C[C@@H]1C[C@@H]1NC(=O)Nc1cc2cc(c(F)c(N)c2cn1)-c1cnc2OCCNc2c1C |r| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598317
(1-(8-Amino-7-fluoro-6-(4-methyl- 5,6,7,8-tetrahydr...)Show SMILES Cc1c2NCCCc2ncc1-c1cc2cc(NC(=O)NC3CC4(C3)CN(CC(F)F)C4)ncc2c(N)c1F | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598318
(1-(8-Amino-7-fluoro-6-(4-methyl-5,6,7,8-tetrahydro...)Show SMILES Cc1c2NCCCc2ncc1-c1cc2cc(NC(=O)N[C@H]3C[C@@]4(C3)CCOC4)ncc2c(N)c1F |r,wD:20.21,22.23,(1.96,-.42,;3.29,.35,;4.62,-.42,;4.62,-1.96,;5.96,-2.73,;7.29,-1.96,;7.29,-.42,;5.96,.35,;5.96,1.89,;4.62,2.66,;3.29,1.89,;1.96,2.66,;.62,1.89,;-.71,2.66,;-2.04,1.89,;-3.38,2.66,;-4.71,1.89,;-4.71,.35,;-3.38,-.42,;-6.05,-.42,;-6.05,-1.96,;-7.13,-3.05,;-6.05,-4.14,;-4.96,-3.05,;-7.29,-5.04,;-6.82,-6.51,;-5.28,-6.51,;-4.8,-5.04,;-3.38,4.2,;-2.04,4.97,;-.71,4.2,;.62,4.97,;.62,6.51,;1.96,4.2,;3.29,4.97,)| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598319
(1-(8-Amino-7-fluoro-6-(4-methyl-5,6,7,8-tetrahydro...)Show SMILES Cc1c2NCCCc2ncc1-c1cc2cc(NC(=O)N[C@H]3C[C@@]4(C3)CCOC4)ncc2c(N)c1F |r,wU:20.21,22.24,(1.96,-.42,;3.29,.35,;4.62,-.42,;4.62,-1.96,;5.96,-2.73,;7.29,-1.96,;7.29,-.42,;5.96,.35,;5.96,1.89,;4.62,2.66,;3.29,1.89,;1.96,2.66,;.62,1.89,;-.71,2.66,;-2.04,1.89,;-3.38,2.66,;-4.71,1.89,;-4.71,.35,;-3.38,-.42,;-6.05,-.42,;-6.05,-1.96,;-4.96,-3.05,;-6.05,-4.14,;-7.13,-3.05,;-7.29,-5.04,;-6.82,-6.51,;-5.28,-6.51,;-4.8,-5.04,;-3.38,4.2,;-2.04,4.97,;-.71,4.2,;.62,4.97,;.62,6.51,;1.96,4.2,;3.29,4.97,)| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598322
(1-(8-amino-7-fluoro-6-(8-methyl-2,3- dihydro-1H-py...)Show SMILES CC(C)NC(=O)Nc1cc2cc(c(F)c(N)c2cn1)-c1cnc2OCCNc2c1C | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598323
(1-(8-Amino-7-fluoro-6-(8-methyl-2,3-dihydro-1H-pyr...)Show SMILES Cc1c2NCCOc2ncc1-c1cc2cc(NC(=O)N[C@H]3CCOC[C@H]3F)ncc2c(N)c1F |r| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598323
(1-(8-Amino-7-fluoro-6-(8-methyl-2,3-dihydro-1H-pyr...)Show SMILES Cc1c2NCCOc2ncc1-c1cc2cc(NC(=O)N[C@H]3CCOC[C@H]3F)ncc2c(N)c1F |r| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598325
(1-(8-Amino-7-fluoro-6-(8-methyl-2,3-dihydro-1H-pyr...)Show SMILES Cc1c2NCCOc2ncc1-c1cc2cc(NC(=O)N[C@@H]3C[C@H](F)C3)ncc2c(N)c1F |r,wU:20.21,22.24,(1.88,-.84,;3.21,-.07,;4.55,-.84,;4.55,-2.38,;5.88,-3.15,;7.21,-2.38,;7.21,-.84,;5.88,-.07,;5.88,1.47,;4.55,2.24,;3.21,1.47,;1.88,2.24,;.54,1.47,;-.79,2.24,;-2.12,1.47,;-3.46,2.24,;-4.79,1.47,;-4.79,-.07,;-3.46,-.84,;-6.12,-.84,;-6.12,-2.38,;-7.21,-3.47,;-6.12,-4.55,;-6.12,-6.09,;-5.03,-3.47,;-3.46,3.78,;-2.12,4.55,;-.79,3.78,;.54,4.55,;.54,6.09,;1.88,3.78,;3.21,4.55,)| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598329
(1-(8-Amino-7-fluoro-6-(8-methyl-2,3-dihydro-1H-pyr...)Show SMILES CO[C@@H]1COCC[C@@H]1NC(=O)Nc1cc2cc(c(F)c(N)c2cn1)-c1cnc2OCCNc2c1C |r| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598204
((1R,5S,6s)-3-Oxabicyclo[3.1.0]hexan-6-yl(8-amino-7...)Show SMILES Cc1c2NCCOc2ncc1-c1cc2cc(NC(=O)OC3[C@@H]4COC[C@@H]34)ncc2c(N)c1F |r| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598210
(US11612606, Compound 546a | trans-4-Methoxytetrahy...)Show SMILES CO[C@@H]1COC[C@@H]1OC(=O)Nc1cc2cc(c(F)c(N)c2cn1)-c1cnc2OCCNc2c1C |r| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598214
((1s,3s)-3-(2-Cyanopropan-2- | US11612606, Compound...)Show SMILES Cc1c2NCCOc2ncc1-c1cc2cc(NC(=O)O[C@H]3C[C@H](C3)C(C)(C)C#N)ncc2c(N)c1F |r,wD:20.21,22.26,(2.67,-1.22,;4,-.45,;5.33,-1.22,;5.33,-2.76,;6.67,-3.53,;8,-2.76,;8,-1.22,;6.67,-.45,;6.67,1.09,;5.33,1.86,;4,1.09,;2.67,1.86,;1.33,1.09,;,1.86,;-1.33,1.09,;-2.67,1.86,;-4,1.09,;-5.33,1.86,;-5.33,3.4,;-6.67,1.09,;-6.67,-.45,;-7.76,-1.54,;-6.67,-2.63,;-5.58,-1.54,;-6.67,-4.17,;-8,-4.94,;-5.33,-3.4,;-5.33,-4.94,;-4,-5.71,;-2.67,3.4,;-1.33,4.17,;,3.4,;1.33,4.17,;1.33,5.71,;2.67,3.4,;4,4.17,)| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598215
((1r,3r)-3-(2-Cyanopropan-2- yl)cyclobutyl(8-amino-...)Show SMILES Cc1c2NCCOc2ncc1-c1cc2cc(NC(=O)O[C@H]3C[C@@H](C3)C(C)(C)C#N)ncc2c(N)c1F |r,wU:20.21,wD:22.26,(2.67,-1.22,;4,-.45,;5.33,-1.22,;5.33,-2.76,;6.67,-3.53,;8,-2.76,;8,-1.22,;6.67,-.45,;6.67,1.09,;5.33,1.86,;4,1.09,;2.67,1.86,;1.33,1.09,;,1.86,;-1.33,1.09,;-2.67,1.86,;-4,1.09,;-5.33,1.86,;-5.33,3.4,;-6.67,1.09,;-6.67,-.45,;-5.58,-1.54,;-6.67,-2.63,;-7.76,-1.54,;-6.67,-4.17,;-8,-4.94,;-5.33,-3.4,;-5.33,-4.94,;-4,-5.71,;-2.67,3.4,;-1.33,4.17,;,3.4,;1.33,4.17,;1.33,5.71,;2.67,3.4,;4,4.17,)| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598216
((1r,3r)-3-Morpholinocyclobutyl(8- | US11612606, Co...)Show SMILES Cc1c2NCCOc2ncc1-c1cc2cc(NC(=O)O[C@H]3CC(C3)N3CCOCC3)ncc2c(N)c1F |r,wU:20.21,(1.94,.72,;3.28,1.47,;4.67,.7,;4.67,-.84,;6,-1.61,;7.34,-.84,;7.34,.7,;6,1.47,;6,3.01,;4.67,3.78,;3.33,3.01,;2,3.78,;.67,3.01,;-.67,3.78,;-2,3.01,;-3.33,3.78,;-4.67,3.01,;-4.67,1.47,;-3.33,.7,;-6,.7,;-6,-.84,;-4.91,-1.93,;-6,-3.01,;-7.09,-1.93,;-6,-4.55,;-7.34,-5.32,;-7.34,-6.86,;-6,-7.63,;-4.67,-6.86,;-4.67,-5.32,;-3.33,5.32,;-2,6.09,;-.67,5.32,;.67,6.09,;.67,7.63,;2,5.32,;3.33,6.09,)| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598218
((1s,3s)-3-Cyclopropyl-3- | US11612606, Compound 55...)Show SMILES Cc1c2NCCOc2ncc1-c1cc2cc(NC(=O)OC3CC(O)(C3)C3CC3)ncc2c(N)c1F |(2.62,-.32,;3.96,.45,;5.29,-.32,;5.29,-1.86,;6.62,-2.63,;7.96,-1.86,;7.96,-.32,;6.62,.45,;6.62,1.99,;5.29,2.76,;3.96,1.99,;2.62,2.76,;1.29,1.99,;-.05,2.76,;-1.38,1.99,;-2.71,2.76,;-4.05,1.99,;-4.05,.45,;-2.71,-.32,;-5.38,-.32,;-5.38,-1.86,;-6.47,-2.95,;-5.38,-4.04,;-4.29,-5.12,;-4.29,-2.95,;-6.47,-5.12,;-7.96,-5.52,;-6.87,-6.61,;-2.71,4.3,;-1.38,5.07,;-.05,4.3,;1.29,5.07,;1.29,6.61,;2.62,4.3,;3.96,5.07,)| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598220
((1s,3s)-3-hydroxycyclobutyl(8-amino-7- | US1161260...)Show SMILES Cc1c2NCCCc2ncc1-c1cc2cc(NC(=O)O[C@@H]3C[C@H](O)C3)ncc2c(N)c1F |r,wU:20.21,22.24,(1.88,-.84,;3.21,-.07,;4.55,-.84,;4.55,-2.38,;5.88,-3.15,;7.21,-2.38,;7.21,-.84,;5.88,-.07,;5.88,1.47,;4.55,2.24,;3.21,1.47,;1.88,2.24,;.54,1.47,;-.79,2.24,;-2.12,1.47,;-3.46,2.24,;-4.79,1.47,;-4.79,-.07,;-3.46,-.84,;-6.12,-.84,;-6.12,-2.38,;-7.21,-3.47,;-6.12,-4.55,;-6.12,-6.09,;-5.03,-3.47,;-3.46,3.78,;-2.12,4.55,;-.79,3.78,;.54,4.55,;.54,6.09,;1.88,3.78,;3.21,4.55,)| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598222
(US11612606, Compound 555a | trans-4-Methyltetrahyd...)Show SMILES CCc1c2NCCOc2ncc1-c1cc2cc(NC(=O)OC3COCC3C)ncc2c(N)c1F | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598223
((3R,4S)-4-Methyltetrahydrofuran-3-yl(8- amino-6-(8...)Show SMILES CCc1c2NCCOc2ncc1-c1cc2cc(NC(=O)O[C@H]3COC[C@@H]3C)ncc2c(N)c1F |r| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598225
((3R,4S)-4-Methyltetrahydrofuran-3-yl(8- amino-6-(8...)Show SMILES C[C@H]1COC[C@@H]1OC(=O)Nc1cc2cc(cc(N)c2cn1)-c1cnc2OCCNc2c1C |r| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598226
((1s,3s)-3-Cyanocyclobutyl(8-amino-6- | US11612606,...)Show SMILES Cc1c2NCCOc2ncc1-c1cc(N)c2cnc(NC(=O)O[C@H]3C[C@H](C3)C#N)cc2c1 |r,wU:23.24,25.29,(1.88,-.07,;3.21,.7,;4.55,-.07,;4.55,-1.61,;5.88,-2.38,;7.21,-1.61,;7.21,-.07,;5.88,.7,;5.88,2.24,;4.55,3.01,;3.21,2.24,;1.88,3.01,;1.88,4.55,;.54,5.32,;.54,6.86,;-.79,4.55,;-2.12,5.32,;-3.46,4.55,;-3.46,3.01,;-4.79,2.24,;-4.79,.7,;-3.46,-.07,;-6.12,-.07,;-6.12,-1.61,;-5.03,-2.69,;-6.12,-3.78,;-7.21,-2.69,;-6.12,-5.32,;-6.12,-6.86,;-2.12,2.24,;-.79,3.01,;.54,2.24,)| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598231
(US11612606, Compound 559c | trans-2-Methylcyclobut...)Show SMILES C[C@@H]1CC[C@H]1OC(=O)Nc1cc2cc(c(F)c(N)c2cn1)-c1cnc2OCCNc2c1C |r| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598232
((1S,2S)-2-Methylcyclobutyl(8-amino-7- fluoro-6-(8-...)Show SMILES C[C@H]1CC[C@@H]1OC(=O)Nc1cc2cc(c(F)c(N)c2cn1)-c1cnc2OCCNc2c1C |r| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598249
((1s,3s)-3-(Hydroxymethyl)cyclobutyl(8- amino-7-flu...)Show SMILES Cc1c2NCCOc2ncc1-c1cc2cc(NC(=O)O[C@@H]3C[C@H](CO)C3)ncc2c(N)c1F |r,wD:20.21,22.24,(2.55,-1.61,;3.88,-.84,;5.21,-1.61,;5.21,-3.15,;6.55,-3.92,;7.88,-3.15,;7.88,-1.61,;6.55,-.84,;6.55,.7,;5.21,1.47,;3.88,.7,;2.55,1.47,;1.21,.7,;-.12,1.47,;-1.46,.7,;-2.79,1.47,;-4.12,.7,;-5.46,1.47,;-5.46,3.01,;-6.79,.7,;-6.79,-.84,;-5.7,-1.93,;-6.79,-3.01,;-6.79,-4.55,;-5.46,-5.32,;-7.88,-1.93,;-2.79,3.01,;-1.46,3.78,;-.12,3.01,;1.21,3.78,;1.21,5.32,;2.55,3.01,;3.88,3.78,)| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598250
((1s,3s)-3-(Methylsulfonyl)cyclobutyl(8- | US116126...)Show SMILES Cc1c2NCCOc2ncc1-c1cc2cc(NC(=O)O[C@H]3C[C@H](C3)S(C)(=O)=O)ncc2c(N)c1F |r,wU:20.21,22.26,(2.1,-.07,;3.44,.7,;4.77,-.07,;4.77,-1.61,;6.1,-2.38,;7.44,-1.61,;7.44,-.07,;6.1,.7,;6.1,2.24,;4.77,3.01,;3.44,2.24,;2.1,3.01,;.77,2.24,;-.56,3.01,;-1.9,2.24,;-3.23,3.01,;-4.56,2.24,;-4.56,.7,;-3.23,-.07,;-5.9,-.07,;-5.9,-1.61,;-4.81,-2.69,;-5.9,-3.78,;-6.99,-2.69,;-5.9,-5.32,;-5.9,-6.86,;-4.36,-5.32,;-7.44,-5.32,;-3.23,4.55,;-1.9,5.32,;-.56,4.55,;.77,5.32,;.77,6.86,;2.1,4.55,;3.44,5.32,)| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598254
((1R,3s)-3-((S)-1- Hydroxyethyl)cyclobutyl(8-amino-...)Show SMILES C[C@H](O)[C@H]1C[C@@H](C1)OC(=O)Nc1cc2cc(c(F)c(N)c2cn1)-c1cnc2OCCNc2c1C |r,wU:3.2,1.1,wD:5.7,(-8,-5.32,;-6.67,-4.55,;-5.33,-5.32,;-6.67,-3.01,;-7.76,-1.93,;-6.67,-.84,;-5.58,-1.93,;-6.67,.7,;-5.33,1.47,;-5.33,3.01,;-4,.7,;-2.67,1.47,;-1.33,.7,;,1.47,;1.33,.7,;2.67,1.47,;2.67,3.01,;4,3.78,;1.33,3.78,;1.33,5.32,;,3.01,;-1.33,3.78,;-2.67,3.01,;4,.7,;5.33,1.47,;6.67,.7,;6.67,-.84,;8,-1.61,;8,-3.15,;6.67,-3.92,;5.33,-3.15,;5.33,-1.61,;4,-.84,;2.67,-1.61,)| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598256
((1s,3s)-3-(2-Hydroxypropan-2- yl)cyclobutyl(8-amin...)Show SMILES Cc1c2NCCOc2ncc1-c1cc2cc(NC(=O)O[C@H]3C[C@H](C3)C(C)(C)O)ncc2c(N)c1F |r,wD:20.21,22.26,(2.67,-1.22,;4,-.45,;5.33,-1.22,;5.33,-2.76,;6.67,-3.53,;8,-2.76,;8,-1.22,;6.67,-.45,;6.67,1.09,;5.33,1.86,;4,1.09,;2.67,1.86,;1.33,1.09,;,1.86,;-1.33,1.09,;-2.67,1.86,;-4,1.09,;-5.33,1.86,;-5.33,3.4,;-6.67,1.09,;-6.67,-.45,;-7.76,-1.54,;-6.67,-2.63,;-5.58,-1.54,;-6.67,-4.17,;-5.33,-4.94,;-8,-4.94,;-6.67,-5.71,;-2.67,3.4,;-1.33,4.17,;,3.4,;1.33,4.17,;1.33,5.71,;2.67,3.4,;4,4.17,)| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598257
((1R,5S,9s)-7-(Oxetan-3-yl)-3-oxa-7- | US11612606, ...)Show SMILES Cc1c2NCCOc2ncc1-c1cc2cc(NC(=O)OC3C4COCC3CN(C4)C3COC3)ncc2c(N)c1F |THB:29:27:20:22.24.23,19:20:28.27.26:22.24.23| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598258
((1r,3r)-3-Methoxycyclobutyl(8-amino-7- | US1161260...)Show SMILES CO[C@H]1C[C@@H](C1)OC(=O)Nc1cc2cc(c(F)c(N)c2cn1)-c1cnc2OCCNc2c1C |r,wU:4.6,wD:2.1,(-8,-5.32,;-6.67,-4.55,;-6.67,-3.01,;-5.58,-1.93,;-6.67,-.84,;-7.76,-1.93,;-6.67,.7,;-5.33,1.47,;-5.33,3.01,;-4,.7,;-2.67,1.47,;-1.33,.7,;,1.47,;1.33,.7,;2.67,1.47,;2.67,3.01,;4,3.78,;1.33,3.78,;1.33,5.32,;,3.01,;-1.33,3.78,;-2.67,3.01,;4,.7,;5.33,1.47,;6.67,.7,;6.67,-.84,;8,-1.61,;8,-3.15,;6.67,-3.92,;5.33,-3.15,;5.33,-1.61,;4,-.84,;2.67,-1.61,)| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598260
((1r,3r)-3-(Difluoromethyl)cyclobutyl(8- amino-7-fl...)Show SMILES Cc1c2NCCOc2ncc1-c1cc2cc(NC(=O)O[C@H]3C[C@@H](C3)C(F)F)ncc2c(N)c1F |r,wU:20.21,wD:22.26,(2.67,-1.61,;4,-.84,;5.33,-1.61,;5.33,-3.15,;6.67,-3.92,;8,-3.15,;8,-1.61,;6.67,-.84,;6.67,.7,;5.33,1.47,;4,.7,;2.67,1.47,;1.33,.7,;,1.47,;-1.33,.7,;-2.67,1.47,;-4,.7,;-5.33,1.47,;-5.33,3.01,;-6.67,.7,;-6.67,-.84,;-5.58,-1.93,;-6.67,-3.01,;-7.76,-1.93,;-6.67,-4.55,;-8,-5.32,;-5.33,-5.32,;-2.67,3.01,;-1.33,3.78,;,3.01,;1.33,3.78,;1.33,5.32,;2.67,3.01,;4,3.78,)| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598264
(7-Azaspiro[3.5]nonan-2-yl(8-amino-7- fluoro-6-(8-m...)Show SMILES Cc1c2NCCOc2ncc1-c1cc2cc(NC(=O)OC3CC4(C3)CCNCC4)ncc2c(N)c1F | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598136
(Cyclobutyl(8-amino-7-fluoro-6-(8- methyl-2,3-dihyd...)Show SMILES Cc1c2NCCOc2ncc1-c1cc2cc(NC(=O)OC3CCC3)ncc2c(N)c1F | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598139
(2-(2,2-Difluoroethyl)-2- azaspiro[3.3]heptan-6-yl(...)Show SMILES Cc1c2NCCOc2ncc1-c1cc2cc(NC(=O)OC3CC4(C3)CN(CC(F)F)C4)ncc2c(N)c1F | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase kinase 1
(Homo sapiens (Human)) | BDBM598140
((1R,5S,6r)-3-Isopropyl-3- | US11612606, Compound 4...)Show SMILES CC(C)N1C[C@H]2[C@@H](C1)[C@@H]2OC(=O)Nc1cc2cc(c(F)c(N)c2cn1)-c1cnc2OCCNc2c1C |r| | PDB
NCI pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
TBD |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20Z776H |
More data for this
Ligand-Target Pair | |
Search and Browse
