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SMILES: CCN1CCC(CC1)c1nc(COc2cc3ncnc(Nc4ccc(Cl)c(Cl)c4)c3cc2OC)no1

InChI Key: InChIKey=QWTRRGLWVSSIML-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 5 hits for monomerid = 351518   
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
Ephrin type-B receptor 4


(Homo sapiens (Human))
BDBM351518
PNG
(N-(3,4-dichlorophenyl)-7-({[5-(1- ethylpiperidin-4...)
Show SMILES CCN1CCC(CC1)c1nc(COc2cc3ncnc(Nc4ccc(Cl)c(Cl)c4)c3cc2OC)no1
Show InChI InChI=1S/C25H26Cl2N6O3/c1-3-33-8-6-15(7-9-33)25-31-23(32-36-25)13-35-22-12-20-17(11-21(22)34-2)24(29-14-28-20)30-16-4-5-18(26)19(27)10-16/h4-5,10-12,14-15H,3,6-9,13H2,1-2H3,(H,28,29,30)
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n/an/a<50n/an/an/an/an/an/a



SYMPHONY EVOLUTION, INC.

US Patent


Assay Description
In AlphaScreen, when the donor and acceptor beads are close in proximity, a series of photochemical events will give rise to a fluorescent signal upo...


US Patent US9796704 (2017)


BindingDB Entry DOI: 10.7270/Q28K7C6V
More data for this
Ligand-Target Pair
Ephrin type-A receptor 2


(Homo sapiens (Human))
BDBM351518
PNG
(N-(3,4-dichlorophenyl)-7-({[5-(1- ethylpiperidin-4...)
Show SMILES CCN1CCC(CC1)c1nc(COc2cc3ncnc(Nc4ccc(Cl)c(Cl)c4)c3cc2OC)no1
Show InChI InChI=1S/C25H26Cl2N6O3/c1-3-33-8-6-15(7-9-33)25-31-23(32-36-25)13-35-22-12-20-17(11-21(22)34-2)24(29-14-28-20)30-16-4-5-18(26)19(27)10-16/h4-5,10-12,14-15H,3,6-9,13H2,1-2H3,(H,28,29,30)
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n/an/a<50n/an/an/an/an/an/a



SYMPHONY EVOLUTION, INC.

US Patent


Assay Description
In AlphaScreen, when the donor and acceptor beads are close in proximity, a series of photochemical events will give rise to a fluorescent signal upo...


US Patent US9796704 (2017)


BindingDB Entry DOI: 10.7270/Q28K7C6V
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM351518
PNG
(N-(3,4-dichlorophenyl)-7-({[5-(1- ethylpiperidin-4...)
Show SMILES CCN1CCC(CC1)c1nc(COc2cc3ncnc(Nc4ccc(Cl)c(Cl)c4)c3cc2OC)no1
Show InChI InChI=1S/C25H26Cl2N6O3/c1-3-33-8-6-15(7-9-33)25-31-23(32-36-25)13-35-22-12-20-17(11-21(22)34-2)24(29-14-28-20)30-16-4-5-18(26)19(27)10-16/h4-5,10-12,14-15H,3,6-9,13H2,1-2H3,(H,28,29,30)
PDB
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n/an/a<50n/an/an/an/an/an/a



SYMPHONY EVOLUTION, INC.

US Patent


Assay Description
In AlphaScreen, when the donor and acceptor beads are close in proximity, a series of photochemical events will give rise to a fluorescent signal upo...


US Patent US9796704 (2017)


BindingDB Entry DOI: 10.7270/Q28K7C6V
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM351518
PNG
(N-(3,4-dichlorophenyl)-7-({[5-(1- ethylpiperidin-4...)
Show SMILES CCN1CCC(CC1)c1nc(COc2cc3ncnc(Nc4ccc(Cl)c(Cl)c4)c3cc2OC)no1
Show InChI InChI=1S/C25H26Cl2N6O3/c1-3-33-8-6-15(7-9-33)25-31-23(32-36-25)13-35-22-12-20-17(11-21(22)34-2)24(29-14-28-20)30-16-4-5-18(26)19(27)10-16/h4-5,10-12,14-15H,3,6-9,13H2,1-2H3,(H,28,29,30)
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n/an/a<50n/an/an/an/an/an/a



SYMPHONY EVOLUTION, INC.

US Patent


Assay Description
In AlphaScreen, when the donor and acceptor beads are close in proximity, a series of photochemical events will give rise to a fluorescent signal upo...


US Patent US9796704 (2017)


BindingDB Entry DOI: 10.7270/Q28K7C6V
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM351518
PNG
(N-(3,4-dichlorophenyl)-7-({[5-(1- ethylpiperidin-4...)
Show SMILES CCN1CCC(CC1)c1nc(COc2cc3ncnc(Nc4ccc(Cl)c(Cl)c4)c3cc2OC)no1
Show InChI InChI=1S/C25H26Cl2N6O3/c1-3-33-8-6-15(7-9-33)25-31-23(32-36-25)13-35-22-12-20-17(11-21(22)34-2)24(29-14-28-20)30-16-4-5-18(26)19(27)10-16/h4-5,10-12,14-15H,3,6-9,13H2,1-2H3,(H,28,29,30)
PDB
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n/an/a<50n/an/an/an/an/an/a



SYMPHONY EVOLUTION, INC.

US Patent


Assay Description
In AlphaScreen, when the donor and acceptor beads are close in proximity, a series of photochemical events will give rise to a fluorescent signal upo...


US Patent US9796704 (2017)


BindingDB Entry DOI: 10.7270/Q28K7C6V
More data for this
Ligand-Target Pair