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BDBM50335321 2-(Methyl-4-pyridine)-4-(5-methyl-1H-pyrazol-3-ylamino)-2Hphthalazin-1-one::CHEMBL1651481

SMILES: Cc1cc(Nc2nn(Cc3ccncc3)c(=O)c3ccccc23)[nH]n1

InChI Key: InChIKey=CJFBBEOLBIMHEX-UHFFFAOYSA-N

Data: 2 IC50

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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 = 50335321   
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 A


(Homo sapiens (Human))
BDBM50335321
PNG
(2-(Methyl-4-pyridine)-4-(5-methyl-1H-pyrazol-3-yla...)
Show SMILES Cc1cc(Nc2nn(Cc3ccncc3)c(=O)c3ccccc23)[nH]n1
Show InChI InChI=1S/C18H16N6O/c1-12-10-16(22-21-12)20-17-14-4-2-3-5-15(14)18(25)24(23-17)11-13-6-8-19-9-7-13/h2-10H,11H2,1H3,(H2,20,21,22,23)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 270n/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
Aurora kinase B


(Homo sapiens (Human))
BDBM50335321
PNG
(2-(Methyl-4-pyridine)-4-(5-methyl-1H-pyrazol-3-yla...)
Show SMILES Cc1cc(Nc2nn(Cc3ccncc3)c(=O)c3ccccc23)[nH]n1
Show InChI InChI=1S/C18H16N6O/c1-12-10-16(22-21-12)20-17-14-4-2-3-5-15(14)18(25)24(23-17)11-13-6-8-19-9-7-13/h2-10H,11H2,1H3,(H2,20,21,22,23)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.70E+4n/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