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BDBM50443511 CHEMBL3087818

SMILES: Clc1cnc2nc[nH]c2c1Oc1ccc(cc1)C(=O)Nc1ccccc1

InChI Key: InChIKey=YIHBMYWIHTUMMS-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50443511   
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))
BDBM50443511
PNG
(CHEMBL3087818)
Show SMILES Clc1cnc2nc[nH]c2c1Oc1ccc(cc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C19H13ClN4O2/c20-15-10-21-18-16(22-11-23-18)17(15)26-14-8-6-12(7-9-14)19(25)24-13-4-2-1-3-5-13/h1-11H,(H,24,25)(H,21,22,23)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.58E+4n/an/an/an/an/an/a



The Institute of Cancer Research

Curated by ChEMBL


Assay Description
Inhibition of N-terminal HIS-tagged aurora-A (unknown origin) using 5FAM-LRRASLG-CONH2 as substrate after 60 mins


J Med Chem 56: 9122-35 (2013)


Article DOI: 10.1021/jm401115g
BindingDB Entry DOI: 10.7270/Q2R78GPN
More data for this
Ligand-Target Pair