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BDBM26273 N-(2-fluorophenyl)-2-{3-[(7-{3-[4-(hydroxymethyl)piperidin-1-yl]propoxy}-6-methoxyquinazolin-4-yl)amino]-1H-pyrazol-5-yl}acetamide::pyrazoloquinazoline deriv., 7

SMILES: COc1cc2c(Nc3cc(CC(=O)Nc4ccccc4F)n[nH]3)ncnc2cc1OCCCN1CCC(CO)CC1

InChI Key: InChIKey=ADTSCWGDALDZSK-UHFFFAOYSA-N

Data: 2 KI

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

Found 2 hits for monomerid = 26273   
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))
BDBM26273
PNG
(N-(2-fluorophenyl)-2-{3-[(7-{3-[4-(hydroxymethyl)p...)
Show SMILES COc1cc2c(Nc3cc(CC(=O)Nc4ccccc4F)n[nH]3)ncnc2cc1OCCCN1CCC(CO)CC1
Show InChI InChI=1S/C29H34FN7O4/c1-40-25-15-21-24(16-26(25)41-12-4-9-37-10-7-19(17-38)8-11-37)31-18-32-29(21)34-27-13-20(35-36-27)14-28(39)33-23-6-3-2-5-22(23)30/h2-3,5-6,13,15-16,18-19,38H,4,7-12,14,17H2,1H3,(H,33,39)(H2,31,32,34,35,36)
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PC cid
PC sid
UniChem

Similars

Article
PubMed
14 -10.6n/an/an/an/an/a7.522



AstraZeneca



Assay Description
In vitro kinase assay using recombinant Aurora B bound to INCENP was incubated at room temperature with substrate, and test compounds in the presence...


J Med Chem 50: 2213-24 (2007)


Article DOI: 10.1021/jm061335f
BindingDB Entry DOI: 10.7270/Q2GQ6W24
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (human))
BDBM26273
PNG
(N-(2-fluorophenyl)-2-{3-[(7-{3-[4-(hydroxymethyl)p...)
Show SMILES COc1cc2c(Nc3cc(CC(=O)Nc4ccccc4F)n[nH]3)ncnc2cc1OCCCN1CCC(CO)CC1
Show InChI InChI=1S/C29H34FN7O4/c1-40-25-15-21-24(16-26(25)41-12-4-9-37-10-7-19(17-38)8-11-37)31-18-32-29(21)34-27-13-20(35-36-27)14-28(39)33-23-6-3-2-5-22(23)30/h2-3,5-6,13,15-16,18-19,38H,4,7-12,14,17H2,1H3,(H,33,39)(H2,31,32,34,35,36)
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.40E+3 -7.98n/an/an/an/an/an/a25



AstraZeneca



Assay Description
In vitro kinase assay using recombinant Aurora A purified from Sf9 cells was incubated at room temperature with substrate, and test compounds in the ...


J Med Chem 50: 2213-24 (2007)


Article DOI: 10.1021/jm061335f
BindingDB Entry DOI: 10.7270/Q2GQ6W24
More data for this
Ligand-Target Pair