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SMILES: COc1cc2c(Nc3ccc(Cl)c(Cl)c3)ncnc2cc1OCc1nc(cs1)-c1ccc(cc1)N1CCCC1

InChI Key: InChIKey=LARWQCXRXJJFLU-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 = 351478   
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))
BDBM351478
PNG
(N-(3,4-dichlorophenyl)-6-(methyloxy)-7-({[4- (4-py...)
Show SMILES COc1cc2c(Nc3ccc(Cl)c(Cl)c3)ncnc2cc1OCc1nc(cs1)-c1ccc(cc1)N1CCCC1
Show InChI InChI=1S/C29H25Cl2N5O2S/c1-37-26-13-21-24(32-17-33-29(21)34-19-6-9-22(30)23(31)12-19)14-27(26)38-15-28-35-25(16-39-28)18-4-7-20(8-5-18)36-10-2-3-11-36/h4-9,12-14,16-17H,2-3,10-11,15H2,1H3,(H,32,33,34)
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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))
BDBM351478
PNG
(N-(3,4-dichlorophenyl)-6-(methyloxy)-7-({[4- (4-py...)
Show SMILES COc1cc2c(Nc3ccc(Cl)c(Cl)c3)ncnc2cc1OCc1nc(cs1)-c1ccc(cc1)N1CCCC1
Show InChI InChI=1S/C29H25Cl2N5O2S/c1-37-26-13-21-24(32-17-33-29(21)34-19-6-9-22(30)23(31)12-19)14-27(26)38-15-28-35-25(16-39-28)18-4-7-20(8-5-18)36-10-2-3-11-36/h4-9,12-14,16-17H,2-3,10-11,15H2,1H3,(H,32,33,34)
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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))
BDBM351478
PNG
(N-(3,4-dichlorophenyl)-6-(methyloxy)-7-({[4- (4-py...)
Show SMILES COc1cc2c(Nc3ccc(Cl)c(Cl)c3)ncnc2cc1OCc1nc(cs1)-c1ccc(cc1)N1CCCC1
Show InChI InChI=1S/C29H25Cl2N5O2S/c1-37-26-13-21-24(32-17-33-29(21)34-19-6-9-22(30)23(31)12-19)14-27(26)38-15-28-35-25(16-39-28)18-4-7-20(8-5-18)36-10-2-3-11-36/h4-9,12-14,16-17H,2-3,10-11,15H2,1H3,(H,32,33,34)
PDB
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PC sid
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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))
BDBM351478
PNG
(N-(3,4-dichlorophenyl)-6-(methyloxy)-7-({[4- (4-py...)
Show SMILES COc1cc2c(Nc3ccc(Cl)c(Cl)c3)ncnc2cc1OCc1nc(cs1)-c1ccc(cc1)N1CCCC1
Show InChI InChI=1S/C29H25Cl2N5O2S/c1-37-26-13-21-24(32-17-33-29(21)34-19-6-9-22(30)23(31)12-19)14-27(26)38-15-28-35-25(16-39-28)18-4-7-20(8-5-18)36-10-2-3-11-36/h4-9,12-14,16-17H,2-3,10-11,15H2,1H3,(H,32,33,34)
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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))
BDBM351478
PNG
(N-(3,4-dichlorophenyl)-6-(methyloxy)-7-({[4- (4-py...)
Show SMILES COc1cc2c(Nc3ccc(Cl)c(Cl)c3)ncnc2cc1OCc1nc(cs1)-c1ccc(cc1)N1CCCC1
Show InChI InChI=1S/C29H25Cl2N5O2S/c1-37-26-13-21-24(32-17-33-29(21)34-19-6-9-22(30)23(31)12-19)14-27(26)38-15-28-35-25(16-39-28)18-4-7-20(8-5-18)36-10-2-3-11-36/h4-9,12-14,16-17H,2-3,10-11,15H2,1H3,(H,32,33,34)
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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