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SMILES: COC(=O)CCCCS(C)(=O)=NC(=O)c1cnc(N)c(c1)C#Cc1cccc(c1)C(=O)Nc1cccc(C)c1

InChI Key: InChIKey=VWWWKWXBDHJDSL-UHFFFAOYSA-N

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 4 hits for monomerid = 208476   
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
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM208476
PNG
(US9266869, 34)
Show SMILES COC(=O)CCCCS(C)(=O)=NC(=O)c1cnc(N)c(c1)C#Cc1cccc(c1)C(=O)Nc1cccc(C)c1
Show InChI InChI=1S/C29H30N4O5S/c1-20-8-6-11-25(16-20)32-28(35)23-10-7-9-21(17-23)13-14-22-18-24(19-31-27(22)30)29(36)33-39(3,37)15-5-4-12-26(34)38-2/h6-11,16-19H,4-5,12,15H2,1-3H3,(H2,30,31)(H,32,35)
PDB
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PC cid
PC sid
UniChem
US Patent
n/an/a 7n/an/an/an/a7.430



Allergan, Inc.

US Patent


Assay Description
Biochemical KDR kinase assays were performed in 96 well microtiter plates that were coated overnight with 75 ug/well of poly-Glu-Tyr (4:1) in 10 mM P...


US Patent US9266869 (2016)


BindingDB Entry DOI: 10.7270/Q2NV9H33
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM208476
PNG
(US9266869, 34)
Show SMILES COC(=O)CCCCS(C)(=O)=NC(=O)c1cnc(N)c(c1)C#Cc1cccc(c1)C(=O)Nc1cccc(C)c1
Show InChI InChI=1S/C29H30N4O5S/c1-20-8-6-11-25(16-20)32-28(35)23-10-7-9-21(17-23)13-14-22-18-24(19-31-27(22)30)29(36)33-39(3,37)15-5-4-12-26(34)38-2/h6-11,16-19H,4-5,12,15H2,1-3H3,(H2,30,31)(H,32,35)
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PC cid
PC sid
UniChem
US Patent
n/an/a 13n/an/an/an/an/a37



Allergan, Inc.

US Patent


Assay Description
Automated FLIPR (Fluorometric Imaging Plate Reader) technology was used to screen for inhibitors of PDGF-induced increases in intracellular calcium l...


US Patent US9266869 (2016)


BindingDB Entry DOI: 10.7270/Q2NV9H33
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM208476
PNG
(US9266869, 34)
Show SMILES COC(=O)CCCCS(C)(=O)=NC(=O)c1cnc(N)c(c1)C#Cc1cccc(c1)C(=O)Nc1cccc(C)c1
Show InChI InChI=1S/C29H30N4O5S/c1-20-8-6-11-25(16-20)32-28(35)23-10-7-9-21(17-23)13-14-22-18-24(19-31-27(22)30)29(36)33-39(3,37)15-5-4-12-26(34)38-2/h6-11,16-19H,4-5,12,15H2,1-3H3,(H2,30,31)(H,32,35)
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UniChem
US Patent
n/an/a 15n/an/an/an/a7.430



Allergan, Inc.

US Patent


Assay Description
Biochemical PDGFRbeta kinase assays were performed in 96 well microtiter plates that were coated overnight with 75 ug of poly-Glu-Tyr (4:1) in 10 mM ...


US Patent US9266869 (2016)


BindingDB Entry DOI: 10.7270/Q2NV9H33
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM208476
PNG
(US9266869, 34)
Show SMILES COC(=O)CCCCS(C)(=O)=NC(=O)c1cnc(N)c(c1)C#Cc1cccc(c1)C(=O)Nc1cccc(C)c1
Show InChI InChI=1S/C29H30N4O5S/c1-20-8-6-11-25(16-20)32-28(35)23-10-7-9-21(17-23)13-14-22-18-24(19-31-27(22)30)29(36)33-39(3,37)15-5-4-12-26(34)38-2/h6-11,16-19H,4-5,12,15H2,1-3H3,(H2,30,31)(H,32,35)
PDB
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PC cid
PC sid
UniChem
US Patent
n/an/a 2n/an/an/an/an/a37



Allergan, Inc.

US Patent


Assay Description
Automated FLIPR (Fluorometric Imaging Plate Reader) technology was used to screen for inhibitors of VEGF induced increases in intracellular calcium...


US Patent US9266869 (2016)


BindingDB Entry DOI: 10.7270/Q2NV9H33
More data for this
Ligand-Target Pair