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BDBM50164144 6-(2-Hydroxy-6-methoxy-phenyl)-8-methyl-2-phenylamino-8H-pyrido[2,3-d]pyrimidin-7-one::CHEMBL180290

SMILES: COc1cccc(O)c1-c1cc2cnc(Nc3ccccc3)nc2n(C)c1=O

InChI Key: InChIKey=XYKJPYZNOLWTGV-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50164144   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Serine/threonine-protein kinase WEE1


(Homo sapiens (Human))
BDBM50164144
PNG
(6-(2-Hydroxy-6-methoxy-phenyl)-8-methyl-2-phenylam...)
Show SMILES COc1cccc(O)c1-c1cc2cnc(Nc3ccccc3)nc2n(C)c1=O |(2.48,4.82,;2.5,3.28,;3.83,2.52,;5.14,3.29,;6.49,2.54,;6.49,1,;5.16,.23,;5.19,-1.31,;3.83,.98,;2.5,.21,;1.19,.97,;-.16,.19,;-1.49,.97,;-2.8,.19,;-2.8,-1.35,;-4.15,-2.12,;-5.48,-1.35,;-5.48,.19,;-6.81,.96,;-8.14,.18,;-8.14,-1.38,;-6.81,-2.13,;-1.49,-2.12,;-.16,-1.34,;1.2,-2.12,;1.2,-3.65,;2.53,-1.34,;3.86,-2.1,)|
Show InChI InChI=1S/C21H18N4O3/c1-25-19-13(12-22-21(24-19)23-14-7-4-3-5-8-14)11-15(20(25)27)18-16(26)9-6-10-17(18)28-2/h3-12,26H,1-2H3,(H,22,23,24)
PDB
MMDB

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KEGG

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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.10E+4n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of checkpoint kinase Wee1


Bioorg Med Chem Lett 15: 1931-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.01.079
BindingDB Entry DOI: 10.7270/Q280524M
More data for this
Ligand-Target Pair