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Compile Data Set for Download or QSAR

Found 13 hits with non-zero delta_G for polymer = 1325,4981
Cell (A)Syringe (B)Cell
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Syringe
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Cell + Syr
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ΔG°
kcal/mole
-TΔS°
kcal/mole
ΔH°
kcal/mole
log KpHTemp
°C
Serine/threonine-protein kinase Aurora-B

(Homo sapiens (Human))
BDBM189380
JPEG
(5-methyl-4-(2-thiazolylazo)resorcinol | PTK66)
GoogleScholar
PDB
PC cid
PC sid
-9.315.45-25.86.83825



Jawaharlal Nehru Centre for Advanced Scientific Research





Chem Biol Drug Des 87: 958-67 (2016)

Serine/threonine-protein kinase Aurora-B

(Homo sapiens (Human))
BDBM189379
JPEG
(5-O-ethyl 3-O-methyl 4-(2,3-dichlorophenyl)-2,6-di...)
GoogleScholar
PDB
DrugBank
PC cid
PC sid
PDB
-8.605.45-3.106.31825



Jawaharlal Nehru Centre for Advanced Scientific Research





Chem Biol Drug Des 87: 958-67 (2016)

Serine/threonine-protein kinase Aurora-B

(Homo sapiens (Human))
BDBM189380
JPEG
(5-methyl-4-(2-thiazolylazo)resorcinol | PTK66)
GoogleScholar
PDB
PC cid
PC sid
-7.886.02-13.95.78825



Jawaharlal Nehru Centre for Advanced Scientific Research





Chem Biol Drug Des 87: 958-67 (2016)

Serine/threonine-protein kinase Aurora-A

(Homo sapiens (human))
BDBM87051
JPEG
(Bisanilinopyrimidine inhibitor, 5 | Bisanilinopyri...)
GoogleScholar
PDB
PC cid
PC sid
PDB
n/a-1.21-11.0n/a7.4025



Moffitt Cancer Center and Research Institute





ACS Chem Biol 7: 698-706 (2012)

Serine/threonine-protein kinase Aurora-A

(Homo sapiens (human))
BDBM87052
JPEG
(Bisanilinopyrimidine inhibitor, 6 | Bisanilinopyri...)
GoogleScholar
PDB
PC cid
PC sid
PDB
n/a-6.20-17.0n/a7.4025



Moffitt Cancer Center and Research Institute





ACS Chem Biol 7: 698-706 (2012)

Serine/threonine-protein kinase Aurora-A

(Homo sapiens (human))
BDBM87053
JPEG
(Bisanilinopyrimidine inhibitor, 7 | Bisanilinopyri...)
GoogleScholar
PDB
PC cid
PC sid
PDB
n/a-6.20-17.0n/a7.4025



Moffitt Cancer Center and Research Institute





ACS Chem Biol 7: 698-706 (2012)

Serine/threonine-protein kinase Aurora-A

(Homo sapiens (human))
BDBM87055
JPEG
(Bisanilinopyrimidine inhibitor, 9 | Bisanilinopyri...)
GoogleScholar
PDB
PC cid
PC sid
PDB
n/a-6.20-16.0n/a7.4025



Moffitt Cancer Center and Research Institute





ACS Chem Biol 7: 698-706 (2012)

Serine/threonine-protein kinase Aurora-A

(Homo sapiens (human))
BDBM87056
JPEG
(VX680)
GoogleScholar
PDB
PC cid
PC sid
n/a-2.14-11.9n/a7.4025



Moffitt Cancer Center and Research Institute





ACS Chem Biol 7: 698-706 (2012)

Serine/threonine-protein kinase Aurora-A

(Homo sapiens (human))
BDBM87047
JPEG
(Bisanilinopyrimidine inhibitor, 1 | Bisanilinopyri...)
GoogleScholar
PDB
PC cid
PC sid
PDB
n/a-3.85-14.1n/a7.4025



Moffitt Cancer Center and Research Institute





ACS Chem Biol 7: 698-706 (2012)

Serine/threonine-protein kinase Aurora-A

(Homo sapiens (human))
BDBM87050
JPEG
(Bisanilinopyrimidine inhibitor, 4 | Bisanilinopyri...)
GoogleScholar
PDB
PC cid
PC sid
PDB
n/a-4.27-14.1n/a7.4025



Moffitt Cancer Center and Research Institute





ACS Chem Biol 7: 698-706 (2012)

Serine/threonine-protein kinase Aurora-A

(Homo sapiens (human))
BDBM87049
JPEG
(Bisanilinopyrimidine inhibitor, 3)
GoogleScholar
PDB
PC cid
PC sid
n/a5.48-3.10n/a7.4025



Moffitt Cancer Center and Research Institute





ACS Chem Biol 7: 698-706 (2012)

Serine/threonine-protein kinase Aurora-A

(Homo sapiens (human))
BDBM87048
JPEG
(Bisanilinopyrimidine inhibitor, 2 | Bisanilinopyri...)
GoogleScholar
PDB
PC cid
PC sid
PDB
n/a-3.35-14.1n/a7.4025



Moffitt Cancer Center and Research Institute





ACS Chem Biol 7: 698-706 (2012)

Serine/threonine-protein kinase Aurora-A

(Homo sapiens (human))
BDBM87054
JPEG
(Bisanilinopyrimidine inhibitor, 8 | Bisanilinopyri...)
GoogleScholar
PDB
PC cid
PC sid
PDB
n/a-4.06-15.0n/a7.4025



Moffitt Cancer Center and Research Institute





ACS Chem Biol 7: 698-706 (2012)