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BDBM240758 US9422307, 42

SMILES: Nc1nc(Nc2ccc(nc2)N2CCOCC2)nc2c(csc12)-c1cnc2ccccc2c1

InChI Key: InChIKey=LWLKLYWYERSFEK-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 240758   
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
Focal adhesion kinase 1


(Homo sapiens (Human))
BDBM240758
PNG
(US9422307, 42)
Show SMILES Nc1nc(Nc2ccc(nc2)N2CCOCC2)nc2c(csc12)-c1cnc2ccccc2c1
Show InChI InChI=1S/C24H21N7OS/c25-23-22-21(18(14-33-22)16-11-15-3-1-2-4-19(15)26-12-16)29-24(30-23)28-17-5-6-20(27-13-17)31-7-9-32-10-8-31/h1-6,11-14H,7-10H2,(H3,25,28,29,30)
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
n/an/a<1.00E+4n/an/an/an/a7.525



KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY

US Patent


Assay Description
Full sequence FAK was purchased from Cell Signaling (Catalog No.: 7796). ULight-poly GT (PerkinElmer #TRF0100-D), Eu-anti-phospho-Tyr (PT66) (PerkinE...


US Patent US9422307 (2016)


BindingDB Entry DOI: 10.7270/Q29885XC
More data for this
Ligand-Target Pair