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BDBM50249420 4-(5-methyl-1H-pyrazol-3-ylamino)-2-(2-oxo-2-phenylethyl)phthalazin-1(2H)-one::CHEMBL474651

SMILES: Cc1cc(Nc2nn(CC(=O)c3ccccc3)c(=O)c3ccccc23)[nH]n1

InChI Key: InChIKey=ZYWAUCIAPLYMIZ-UHFFFAOYSA-N

Data: 3 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50249420   
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
Aurora kinase B


(Homo sapiens (Human))
BDBM50249420
PNG
(4-(5-methyl-1H-pyrazol-3-ylamino)-2-(2-oxo-2-pheny...)
Show SMILES Cc1cc(Nc2nn(CC(=O)c3ccccc3)c(=O)c3ccccc23)[nH]n1
Show InChI InChI=1S/C20H17N5O2/c1-13-11-18(23-22-13)21-19-15-9-5-6-10-16(15)20(27)25(24-19)12-17(26)14-7-3-2-4-8-14/h2-11H,12H2,1H3,(H2,21,22,23,24)
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Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Evotec (UK) Ltd.

Curated by ChEMBL


Assay Description
Inhibition of Aurora B by ELISA


J Med Chem 54: 312-9 (2011)


Article DOI: 10.1021/jm101346r
BindingDB Entry DOI: 10.7270/Q29P32MB
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM50249420
PNG
(4-(5-methyl-1H-pyrazol-3-ylamino)-2-(2-oxo-2-pheny...)
Show SMILES Cc1cc(Nc2nn(CC(=O)c3ccccc3)c(=O)c3ccccc23)[nH]n1
Show InChI InChI=1S/C20H17N5O2/c1-13-11-18(23-22-13)21-19-15-9-5-6-10-16(15)20(27)25(24-19)12-17(26)14-7-3-2-4-8-14/h2-11H,12H2,1H3,(H2,21,22,23,24)
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PubMed
n/an/a 71n/an/an/an/an/an/a



Evotec (UK) Ltd.

Curated by ChEMBL


Assay Description
Inhibition of Aurora A by ELISA


J Med Chem 54: 312-9 (2011)


Article DOI: 10.1021/jm101346r
BindingDB Entry DOI: 10.7270/Q29P32MB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM50249420
PNG
(4-(5-methyl-1H-pyrazol-3-ylamino)-2-(2-oxo-2-pheny...)
Show SMILES Cc1cc(Nc2nn(CC(=O)c3ccccc3)c(=O)c3ccccc23)[nH]n1
Show InChI InChI=1S/C20H17N5O2/c1-13-11-18(23-22-13)21-19-15-9-5-6-10-16(15)20(27)25(24-19)12-17(26)14-7-3-2-4-8-14/h2-11H,12H2,1H3,(H2,21,22,23,24)
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Article
PubMed
n/an/a 7.67E+3n/an/an/an/an/an/a



Sichuan University

Curated by ChEMBL


Assay Description
Inhibition of recombinant Syk (unknown origin)


Bioorg Med Chem Lett 19: 1944-9 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.049
BindingDB Entry DOI: 10.7270/Q2WM1D98
More data for this
Ligand-Target Pair