Found 201 hits with Last Name = 'johns' and Initial = 'ma' Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kJ/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622504
(US20230312587, Compound 1)Show SMILES C[C@@H]1N(C)c2nc(NCc3cnn(Cc4ccc(F)cc4)c3)nc(C)c2N(C)C1=O | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622569
((7S)-4,7,8-trimethyl-2-((trans-3-((2-(trifluoromet...)Show SMILES C[C@@H]1N(C)c2nc(N[C@H]3C[C@@H](C3)Oc3ccnc(c3)C(F)(F)F)nc(C)c2NC1=O |wU:8.7,1.0,wD:10.12,(,-3.08,;1.33,-2.31,;2.67,-3.08,;2.67,-4.62,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;8,-4.62,;9.09,-5.71,;8,-6.8,;6.91,-5.71,;8,-8.34,;6.67,-9.11,;5.33,-8.34,;4,-9.11,;4,-10.65,;5.33,-11.42,;6.67,-10.65,;5.33,-12.96,;5.33,-14.5,;3.79,-12.96,;6.87,-12.96,;6.67,-.77,;5.33,,;5.33,1.54,;4,-.77,;2.67,,;1.33,-.77,;)| | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622526
(US20230312587, Compound 3)Show SMILES CC[C@@]1(C)N(C)c2nc(NCc3cnn(Cc4ccc(F)cc4)c3)ncc2N(C)C1=O | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622527
(US20230312587, Compound 4)Show SMILES C[C@@H]1N(C)c2nc(NCc3cnn(Cc4ccc(F)cc4)c3)nc(C)c2NC1=O | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622528
(US20230312587, Compound 5)Show SMILES C[C@@H]1N(C)c2nc(NCc3cnn(CC4CCC4)c3)nc(C)c2NC1=O | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622529
(US20230312587, Compound 6)Show SMILES C[C@@H]1N(C)c2nc(NCc3cnn(CCc4ccc(F)cc4)c3)nc(C)c2NC1=O | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622530
(US20230312587, Compound 7)Show SMILES C[C@@H]1N(C)c2nc(NCc3cnn(CC4CCC4)c3)nc(C)c2N(C)C1=O | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622531
(US20230312587, Compound 8)Show SMILES C[C@@H]1N(C)c2nc(NCc3cnn(CCc4ccc(F)cc4)c3)nc(C)c2N(C)C1=O | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622532
(US20230312587, Compound 9)Show SMILES CC[C@@H]1N(C)c2nc(NCc3cnn(Cc4ccc(F)cc4)c3)ncc2NC1=O | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622533
((7S)-4,5,7,8-tetramethyl-2-(((1-(3,4,5-trifluorobe...)Show SMILES C[C@@H]1N(C)c2nc(NCc3cnn(Cc4cc(F)c(F)c(F)c4)c3)nc(C)c2N(C)C1=O | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622534
((7S)-7-Ethyl-5,8-dimethyl-2-(((1-(3,4,5-trifluorob...)Show SMILES CC[C@@H]1N(C)c2nc(NCc3cnn(Cc4cc(F)c(F)c(F)c4)c3)ncc2N(C)C1=O | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622535
((7S)-5,7-Diethyl-2-(((1-(4-fluorobenzyl)-1H-pyrazo...)Show SMILES CC[C@@H]1N(C)c2nc(NCc3cnn(Cc4ccc(F)cc4)c3)ncc2N(CC)C1=O | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622536
((7S)-8-ethyl-2-(((1-(4-fluorobenzyl)-1H-pyrazol-4-...)Show SMILES CCN1[C@@H](C)C(=O)N(C)c2cnc(NCc3cnn(Cc4ccc(F)cc4)c3)nc12 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622537
(5,8-dimethyl-7-propyl-2-(((1-(3,4,5-trifluorobenzy...)Show SMILES CCCC1N(C)c2nc(NCc3cnn(Cc4cc(F)c(F)c(F)c4)c3)ncc2N(C)C1=O | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622538
(2-(((1-(4-fluorobenzyl)-1H-pyrazol-4-yl)methyl)ami...)Show SMILES CCCC1N(C)c2nc(NCc3cnn(Cc4ccc(F)cc4)c3)ncc2N(C)C1=O | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622539
(5,8-diethyl-2-(((1-(4-fluorobenzyl)-1H-pyrazol-4-y...)Show SMILES CCN1C(C)C(=O)N(CC)c2cnc(NCc3cnn(Cc4ccc(F)cc4)c3)nc12 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622540
((R)-7-ethyl-2-(((1-(4-fluorobenzyl)-1H-pyrazol-4-y...)Show SMILES CCC1N(C(C)C)c2nc(NCc3cnn(Cc4ccc(F)cc4)c3)ncc2N(C)C1=O | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622541
((7S)-5,7,8-triethyl-2-(((1-(4-fluorobenzyl)-1H-pyr...)Show SMILES CCN1C(=O)[C@](C)(CC)N(CC)c2nc(NCc3cnn(Cc4ccc(F)cc4)c3)ncc12 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622542
((7S)-2-(((1-(3,5-difluoro-4-methoxybenzyl)-1H-pyra...)Show SMILES COc1c(F)cc(Cn2cc(CNc3ncc4NC(=O)[C@H](C)N(C)c4n3)cn2)cc1F | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622543
((7S)-2-(((1-(3,5-difluoro-4-methoxybenzyl)-1H-pyra...)Show SMILES COc1c(F)cc(Cn2cc(CNc3nc(C)c4NC(=O)[C@H](C)N(C)c4n3)cn2)cc1F | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622544
((7S)-4,7,8-trimethyl-2-(((1-(3-(trifluoromethyl)be...)Show SMILES C[C@@H]1N(C)c2nc(NCc3cnn(Cc4cccc(c4)C(F)(F)F)c3)nc(C)c2NC1=O | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622545
((7S)-2-(((1-(3,5-difluoro-4-methoxybenzyl)-1H-pyra...)Show SMILES CCN1[C@@H](CCO)C(=O)N(CC)c2cnc(NCc3cnn(Cc4cc(F)c(OC)c(F)c4)c3)nc12 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622546
((7S)-2-(((1-(3,5-difluoro-4-hydroxybenzyl)-1H-pyra...)Show SMILES C[C@@H]1N(C)c2nc(NCc3cnn(Cc4cc(F)c(O)c(F)c4)c3)ncc2NC1=O | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622547
((7S)-5-ethyl-8-isopropyl-7-methyl-2-(((1-(3,4,5-tr...)Show SMILES CCN1C(=O)[C@H](C)N(C(C)C)c2nc(NCc3cnn(Cc4cc(F)c(F)c(F)c4)c3)ncc12 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622548
((7S)-2-(((6-(4-fluorophenoxy)pyridin-3-yl)methyl)a...)Show SMILES C[C@@H]1N(C)c2nc(NCc3ccc(Oc4ccc(F)cc4)nc3)nc(C)c2NC1=O | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622549
( (7S)-2-(((trans-1-(3-(4-fluorophenyl)cyclobutyl)-...)Show SMILES C[C@@H]1N(C)c2nc(NCc3cnn(c3)[C@H]3C[C@@H](C3)c3ccc(F)cc3)nc(C)c2NC1=O |wU:14.14,1.0,wD:16.19,(,-3.08,;1.33,-2.31,;2.67,-3.08,;2.67,-4.62,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;9.34,-2.31,;10.67,-3.08,;10.83,-4.61,;12.34,-4.93,;13.11,-3.6,;12.08,-2.45,;14.64,-3.44,;15.61,-2.24,;16.8,-3.21,;15.84,-4.41,;18.34,-3.05,;18.96,-1.64,;20.49,-1.48,;21.4,-2.73,;22.93,-2.57,;20.77,-4.13,;19.24,-4.29,;6.67,-.77,;5.33,,;5.33,1.54,;4,-.77,;2.67,,;1.33,-.77,;)| | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622550
((7S)-2-(((1-(2-cyclohexylethyl)-1H-pyrazol-4-yl)me...)Show SMILES C[C@@H]1N(C)c2nc(NCc3cnn(CCC4CCCCC4)c3)nc(C)c2NC1=O | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622551
((7S)-2-(((1-(2,3-dihydro-1H-inden-2-yl)-1H-pyrazol...)Show SMILES C[C@@H]1N(C)c2nc(NCc3cnn(c3)C3Cc4ccccc4C3)nc(C)c2NC1=O | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622552
((7S)-4,7,8-trimethyl-2-(((1-((6-(trifluoromethyl)p...)Show SMILES C[C@@H]1N(C)c2nc(NCc3cnn(Cc4ccc(nc4)C(F)(F)F)c3)nc(C)c2NC1=O | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| MCE
PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622553
((7S)-2-(((1-((3,5-dimethylisoxazol-4-yl)methyl)-1H...)Show SMILES C[C@@H]1N(C)c2nc(NCc3cnn(Cc4c(C)noc4C)c3)nc(C)c2NC1=O | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622554
((7S)-4,7,8-trimethyl-2-(((1-((1-methyl-3-(trifluor...)Show SMILES C[C@@H]1N(C)c2nc(NCc3cnn(Cc4cc(nn4C)C(F)(F)F)c3)nc(C)c2NC1=O | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622555
((7S)-4,7,8-trimethyl-2-(((1-((5-(trifluoromethyl)f...)Show SMILES C[C@@H]1N(C)c2nc(NCc3cnn(Cc4ccc(o4)C(F)(F)F)c3)nc(C)c2NC1=O | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622556
(2′-(((1-(4-fluorobenzyl)-1H-pyrazol-4-yl)met...)Show SMILES CN1c2nc(NCc3cnn(Cc4ccc(F)cc4)c3)nc(C)c2NC(=O)C11CC1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622557
(2′-(((1-(4-fluorobenzyl)-1H-pyrazol-4-yl)met...)Show SMILES CN1C(=O)C2(CC2)N(C)c2nc(NCc3cnn(Cc4ccc(F)cc4)c3)nc(C)c12 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622558
(2-(((1-(4-fluorobenzyl)-1H-pyrazol-4-yl)methyl)ami...)Show SMILES CN1C(=O)C(C)(C)N(C)c2nc(NCc3cnn(Cc4ccc(F)cc4)c3)ncc12 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622559
(5,7,7,8-tetramethyl-2-(((1-(3,4,5-trifluorobenzyl)...)Show SMILES CN1C(=O)C(C)(C)N(C)c2nc(NCc3cnn(Cc4cc(F)c(F)c(F)c4)c3)ncc12 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622560
((7R)-5,7,8-triethyl-2-(((1-(4-fluorobenzyl)-1H-pyr...)Show SMILES CCN1C(=O)[C@@](C)(CC)N(CC)c2nc(NCc3cnn(Cc4ccc(F)cc4)c3)ncc12 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622561
((7S)-4,7,8-trimethyl-2-((trans-3-(3,4,5-trifluorop...)Show SMILES C[C@@H]1N(C)c2nc(N[C@H]3C[C@@H](C3)Oc3cc(F)c(F)c(F)c3)nc(C)c2NC1=O |wU:8.7,1.0,wD:10.12,(,-3.08,;1.33,-2.31,;2.67,-3.08,;2.67,-4.62,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;8,-4.62,;9.09,-5.71,;8,-6.8,;6.91,-5.71,;8,-8.34,;6.67,-9.11,;6.67,-10.65,;5.33,-11.42,;5.33,-12.96,;4,-10.65,;2.67,-11.42,;4,-9.11,;2.67,-8.34,;5.33,-8.34,;6.67,-.77,;5.33,,;5.33,1.54,;4,-.77,;2.67,,;1.33,-.77,;)| | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622562
( (7S)-4,7,8-trimethyl-2-((cis-3-(3,4,5-trifluoroph...)Show SMILES C[C@@H]1N(C)c2nc(N[C@H]3C[C@H](C3)Oc3cc(F)c(F)c(F)c3)nc(C)c2NC1=O |wU:8.7,10.12,1.0,(,-3.08,;1.33,-2.31,;2.67,-3.08,;2.67,-4.62,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;8,-4.62,;9.09,-5.71,;8,-6.8,;6.91,-5.71,;8,-8.34,;6.67,-9.11,;6.67,-10.65,;5.33,-11.42,;5.33,-12.96,;4,-10.65,;2.67,-11.42,;4,-9.11,;2.67,-8.34,;5.33,-8.34,;6.67,-.77,;5.33,,;5.33,1.54,;4,-.77,;2.67,,;1.33,-.77,;)| | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622563
( (7S)-4,5,7,8-tetramethyl-2-((trans-3-(3,4,5-trifl...)Show SMILES C[C@@H]1N(C)c2nc(N[C@H]3C[C@@H](C3)Oc3cc(F)c(F)c(F)c3)nc(C)c2N(C)C1=O |wU:8.7,1.0,wD:10.12,(,-3.08,;1.33,-2.31,;2.67,-3.08,;2.67,-4.62,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;8,-4.62,;9.09,-5.71,;8,-6.8,;6.91,-5.71,;8,-8.34,;6.67,-9.11,;6.67,-10.65,;5.33,-11.42,;5.33,-12.96,;4,-10.65,;2.67,-11.42,;4,-9.11,;2.67,-8.34,;5.33,-8.34,;6.67,-.77,;5.33,,;5.33,1.54,;4,-.77,;2.67,,;2.67,1.54,;1.33,-.77,;)| | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622564
((7S)-4,7,8-trimethyl-2-((trans-3-((3,4,5-trifluoro...)Show SMILES C[C@@H]1N(C)c2nc(N[C@H]3C[C@@H](C3)OCc3cc(F)c(F)c(F)c3)nc(C)c2NC1=O |wU:8.7,1.0,wD:10.12,(,-3.08,;1.33,-2.31,;2.67,-3.08,;2.67,-4.62,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;8,-4.62,;9.09,-5.71,;8,-6.8,;6.91,-5.71,;8,-8.34,;9.34,-9.11,;9.34,-10.65,;10.67,-11.42,;10.67,-12.96,;12,-13.73,;9.34,-13.73,;9.34,-15.27,;8,-12.96,;6.67,-13.73,;8,-11.42,;6.67,-.77,;5.33,,;5.33,1.54,;4,-.77,;2.67,,;1.33,-.77,;)| | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622565
((S)-4,7,8-trimethyl-2-(((1R,3R)-3-(3,4,5-trifluoro...)Show SMILES C[C@@H]1N(C)c2nc(N[C@@H]3CC[C@H](C3)Oc3cc(F)c(F)c(F)c3)nc(C)c2NC1=O | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622566
((S)-4,7,8-trimethyl-2-(((1S,3S)-3-(3,4,5-trifluoro...)Show SMILES C[C@@H]1N(C)c2nc(N[C@H]3CC[C@@H](C3)Oc3cc(F)c(F)c(F)c3)nc(C)c2NC1=O | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622567
((7S)-4,7,8-trimethyl-2-((cis-3-((5-(trifluoromethy...)Show SMILES C[C@@H]1N(C)c2nc(N[C@@H]3C[C@H](Cn4nccc4C(F)(F)F)C3)nc(C)c2NC1=O |wU:8.7,10.10,1.0,(,-3.08,;1.33,-2.31,;2.67,-3.08,;2.67,-4.62,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;8,-4.62,;6.91,-5.71,;8,-6.8,;8,-8.34,;9.34,-9.11,;10.74,-8.48,;11.77,-9.63,;11,-10.96,;9.5,-10.64,;8.35,-11.67,;7.21,-12.7,;7.32,-10.53,;9.38,-12.81,;9.09,-5.71,;6.67,-.77,;5.33,,;5.33,1.54,;4,-.77,;2.67,,;1.33,-.77,;)| | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622568
((7S)-4,7,8-trimethyl-2-(((1R,3R)-3-(3-(trifluorome...)Show SMILES C[C@@H]1N(C)c2nc(N[C@@H]3CC[C@H](C3)n3ccc(n3)C(F)(F)F)nc(C)c2NC1=O | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM622525
(US20230312587, Compound 2)Show SMILES CC[C@]1(C)N(C)c2nc(NCc3cnn(Cc4ccc(F)cc4)c3)ncc2N(C)C1=O | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this
Ligand-Target Pair | |
Lysine-specific demethylase 5A [1-1090]
(Homo sapiens (Human)) | BDBM191598
(2-(((2-((2-(dimethylamino)ethyl)(ethyl)amino)-2-ox...)Show InChI InChI=1S/C15H24N4O3/c1-4-19(8-7-18(2)3)14(20)11-16-10-13-9-12(15(21)22)5-6-17-13/h5-6,9,16H,4,7-8,10-11H2,1-3H3,(H,21,22) | PDB
UniProtKB/SwissProt
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| Purchase
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PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 25 | n/a | n/a | n/a | n/a | 7.2 | 25 |
Emory University
| Assay Description
Reactions were performed in 50 mM HEPES [pH 7.2 for KDM5 or pH 7.5 for KDM4A(1-350)] containing 0.01% BSA and 0.01% Tween-20. To each well, 3 μL... |
Cell Chem Biol 23: 769-81 (2016)
Article DOI: 10.1016/j.chembiol.2016.06.006
BindingDB Entry DOI: 10.7270/Q2BZ64VH |
More data for this
Ligand-Target Pair | |
Lysine-specific demethylase 5B
(Homo sapiens (Human)) | BDBM191598
(2-(((2-((2-(dimethylamino)ethyl)(ethyl)amino)-2-ox...)Show InChI InChI=1S/C15H24N4O3/c1-4-19(8-7-18(2)3)14(20)11-16-10-13-9-12(15(21)22)5-6-17-13/h5-6,9,16H,4,7-8,10-11H2,1-3H3,(H,21,22) | PDB
UniProtKB/SwissProt
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PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 30 | n/a | n/a | n/a | n/a | 7.2 | 25 |
Emory University
| Assay Description
Reactions were performed in 50 mM HEPES [pH 7.2 for KDM5 or pH 7.5 for KDM4A(1-350)] containing 0.01% BSA and 0.01% Tween-20. To each well, 3 μL... |
Cell Chem Biol 23: 769-81 (2016)
Article DOI: 10.1016/j.chembiol.2016.06.006
BindingDB Entry DOI: 10.7270/Q2BZ64VH |
More data for this
Ligand-Target Pair | |
Lysine-specific demethylase 5A [1-1090]
(Homo sapiens (Human)) | BDBM191598
(2-(((2-((2-(dimethylamino)ethyl)(ethyl)amino)-2-ox...)Show InChI InChI=1S/C15H24N4O3/c1-4-19(8-7-18(2)3)14(20)11-16-10-13-9-12(15(21)22)5-6-17-13/h5-6,9,16H,4,7-8,10-11H2,1-3H3,(H,21,22) | PDB
UniProtKB/SwissProt
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AffyNet
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UniChem
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| n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
Emory University
| Assay Description
Demethylase reactions and AlphaScreen assays were performed as described (Sayegh et al., 2013), with a few exceptions. All demethylase buffers contai... |
Cell Chem Biol 23: 769-81 (2016)
Article DOI: 10.1016/j.chembiol.2016.06.006
BindingDB Entry DOI: 10.7270/Q2BZ64VH |
More data for this
Ligand-Target Pair | |
Lysine-specific demethylase 5C
(Homo sapiens (Human)) | BDBM191598
(2-(((2-((2-(dimethylamino)ethyl)(ethyl)amino)-2-ox...)Show InChI InChI=1S/C15H24N4O3/c1-4-19(8-7-18(2)3)14(20)11-16-10-13-9-12(15(21)22)5-6-17-13/h5-6,9,16H,4,7-8,10-11H2,1-3H3,(H,21,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| Purchase
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 59 | n/a | n/a | n/a | n/a | 7.2 | 25 |
Emory University
| Assay Description
Reactions were performed in 50 mM HEPES [pH 7.2 for KDM5 or pH 7.5 for KDM4A(1-350)] containing 0.01% BSA and 0.01% Tween-20. To each well, 3 μL... |
Cell Chem Biol 23: 769-81 (2016)
Article DOI: 10.1016/j.chembiol.2016.06.006
BindingDB Entry DOI: 10.7270/Q2BZ64VH |
More data for this
Ligand-Target Pair | |
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