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BDBM24719 13-methyl-8,11,12-triazatetracyclo[7.6.0.0^{2,7}.0^{10,14}]pentadeca-1(9),2,4,6,10,13-hexaene::dihydropyrazolocyclopentaindole, 21

SMILES: Cc1[nH]nc-2c1Cc1c-2[nH]c2ccccc12

InChI Key: InChIKey=JHGGFQICWDUZTH-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 24719   
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))
BDBM24719
PNG
(13-methyl-8,11,12-triazatetracyclo[7.6.0.0^{2,7}.0...)
Show SMILES Cc1[nH]nc-2c1Cc1c-2[nH]c2ccccc12
Show InChI InChI=1S/C13H11N3/c1-7-9-6-10-8-4-2-3-5-11(8)14-12(10)13(9)16-15-7/h2-5,14H,6H2,1H3,(H,15,16)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 880n/an/an/an/a7.522



Genentech



Assay Description
Aurora kinase was assayed in ELISA format using a GST fusion of the N-terminus of Histone H3 as substrate. Plates were coated with substrate, and the...


J Med Chem 51: 4465-75 (2008)


Article DOI: 10.1021/jm800052b
BindingDB Entry DOI: 10.7270/Q2H70D4F
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM24719
PNG
(13-methyl-8,11,12-triazatetracyclo[7.6.0.0^{2,7}.0...)
Show SMILES Cc1[nH]nc-2c1Cc1c-2[nH]c2ccccc12
Show InChI InChI=1S/C13H11N3/c1-7-9-6-10-8-4-2-3-5-11(8)14-12(10)13(9)16-15-7/h2-5,14H,6H2,1H3,(H,15,16)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 870n/an/an/an/a7.522



Genentech



Assay Description
Aurora kinase was assayed in ELISA format using a GST fusion of the N-terminus of Histone H3 as substrate. Plates were coated with substrate, and the...


J Med Chem 51: 4465-75 (2008)


Article DOI: 10.1021/jm800052b
BindingDB Entry DOI: 10.7270/Q2H70D4F
More data for this
Ligand-Target Pair