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BDBM50335323 2-Isopropyl-4-(5-methyl-1H-pyrazol-3-ylamino)-2H-phthalazin-1-one::CHEMBL1651489

SMILES: CC(C)n1nc(Nc2cc(C)n[nH]2)c2ccccc2c1=O

InChI Key: InChIKey=RWGFZZRNLKELRN-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50335323   
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))
BDBM50335323
PNG
(2-Isopropyl-4-(5-methyl-1H-pyrazol-3-ylamino)-2H-p...)
Show SMILES CC(C)n1nc(Nc2cc(C)n[nH]2)c2ccccc2c1=O
Show InChI InChI=1S/C15H17N5O/c1-9(2)20-15(21)12-7-5-4-6-11(12)14(19-20)16-13-8-10(3)17-18-13/h4-9H,1-3H3,(H2,16,17,18,19)
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 35n/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))
BDBM50335323
PNG
(2-Isopropyl-4-(5-methyl-1H-pyrazol-3-ylamino)-2H-p...)
Show SMILES CC(C)n1nc(Nc2cc(C)n[nH]2)c2ccccc2c1=O
Show InChI InChI=1S/C15H17N5O/c1-9(2)20-15(21)12-7-5-4-6-11(12)14(19-20)16-13-8-10(3)17-18-13/h4-9H,1-3H3,(H2,16,17,18,19)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 3.00E+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