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BDBM50249237 2-(4-chlorophenyl)-4-(5-methyl-1H-pyrazol-3-ylamino)phthalazin-1(2H)-one::CHEMBL452355

SMILES: Cc1cc(Nc2nn(-c3ccc(Cl)cc3)c(=O)c3ccccc23)[nH]n1

InChI Key: InChIKey=DFYXAPVQNGLJHI-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 = 50249237   
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))
BDBM50249237
PNG
(2-(4-chlorophenyl)-4-(5-methyl-1H-pyrazol-3-ylamin...)
Show SMILES Cc1cc(Nc2nn(-c3ccc(Cl)cc3)c(=O)c3ccccc23)[nH]n1
Show InChI InChI=1S/C18H14ClN5O/c1-11-10-16(22-21-11)20-17-14-4-2-3-5-15(14)18(25)24(23-17)13-8-6-12(19)7-9-13/h2-10H,1H3,(H2,20,21,22,23)
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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))
BDBM50249237
PNG
(2-(4-chlorophenyl)-4-(5-methyl-1H-pyrazol-3-ylamin...)
Show SMILES Cc1cc(Nc2nn(-c3ccc(Cl)cc3)c(=O)c3ccccc23)[nH]n1
Show InChI InChI=1S/C18H14ClN5O/c1-11-10-16(22-21-11)20-17-14-4-2-3-5-15(14)18(25)24(23-17)13-8-6-12(19)7-9-13/h2-10H,1H3,(H2,20,21,22,23)
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MMDB

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Article
PubMed
n/an/a 93n/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))
BDBM50249237
PNG
(2-(4-chlorophenyl)-4-(5-methyl-1H-pyrazol-3-ylamin...)
Show SMILES Cc1cc(Nc2nn(-c3ccc(Cl)cc3)c(=O)c3ccccc23)[nH]n1
Show InChI InChI=1S/C18H14ClN5O/c1-11-10-16(22-21-11)20-17-14-4-2-3-5-15(14)18(25)24(23-17)13-8-6-12(19)7-9-13/h2-10H,1H3,(H2,20,21,22,23)
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Article
PubMed
n/an/a 1.19E+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