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BDBM240763 US9422307, 47

SMILES: C[C@@H](Nc1nc(NCCN2CCOCC2)nc2c(C=C)csc12)c1ccccc1

InChI Key: InChIKey=FIADULCZQIMHJH-MRXNPFEDSA-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 = 240763   
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))
BDBM240763
PNG
(US9422307, 47)
Show SMILES C[C@@H](Nc1nc(NCCN2CCOCC2)nc2c(C=C)csc12)c1ccccc1 |r|
Show InChI InChI=1S/C22H27N5OS/c1-3-17-15-29-20-19(17)25-22(23-9-10-27-11-13-28-14-12-27)26-21(20)24-16(2)18-7-5-4-6-8-18/h3-8,15-16H,1,9-14H2,2H3,(H2,23,24,25,26)/t16-/m1/s1
PDB
MMDB

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KEGG

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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