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SMILES: COC(=O)CNC(=O)c1cncc2CN(CCc12)c1cccc(c1)C(=O)Nc1cccc(c1)C(C)C

InChI Key: InChIKey=KFYUPVJUHVUEPF-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 3 hits for monomerid = 139626   
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))
BDBM139626
PNG
(US8889870, 174 | US9388176, 174 | US9820989, 174)
Show SMILES COC(=O)CNC(=O)c1cncc2CN(CCc12)c1cccc(c1)C(=O)Nc1cccc(c1)C(C)C
Show InChI InChI=1S/C28H30N4O4/c1-18(2)19-6-4-8-22(12-19)31-27(34)20-7-5-9-23(13-20)32-11-10-24-21(17-32)14-29-15-25(24)28(35)30-16-26(33)36-3/h4-9,12-15,18H,10-11,16-17H2,1-3H3,(H,30,35)(H,31,34)
PDB
MMDB

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PC sid
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Similars

US Patent
49n/an/an/an/an/an/an/an/a



ALLERGAN, INC.

US Patent


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


US Patent US9820989 (2017)


BindingDB Entry DOI: 10.7270/Q2TT4T6G
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM139626
PNG
(US8889870, 174 | US9388176, 174 | US9820989, 174)
Show SMILES COC(=O)CNC(=O)c1cncc2CN(CCc12)c1cccc(c1)C(=O)Nc1cccc(c1)C(C)C
Show InChI InChI=1S/C28H30N4O4/c1-18(2)19-6-4-8-22(12-19)31-27(34)20-7-5-9-23(13-20)32-11-10-24-21(17-32)14-29-15-25(24)28(35)30-16-26(33)36-3/h4-9,12-15,18H,10-11,16-17H2,1-3H3,(H,30,35)(H,31,34)
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt

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antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 49n/an/an/an/a7.4n/a



Allergan, Inc.

US Patent


Assay Description
Biochemical KDR kinase assays were performed in 96 well microliter plates that were coated overnight with 75 .mu.g/well of poly-Glu-Tyr (4:1) in 10 m...


US Patent US8889870 (2014)


BindingDB Entry DOI: 10.7270/Q25B0158
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM139626
PNG
(US8889870, 174 | US9388176, 174 | US9820989, 174)
Show SMILES COC(=O)CNC(=O)c1cncc2CN(CCc12)c1cccc(c1)C(=O)Nc1cccc(c1)C(C)C
Show InChI InChI=1S/C28H30N4O4/c1-18(2)19-6-4-8-22(12-19)31-27(34)20-7-5-9-23(13-20)32-11-10-24-21(17-32)14-29-15-25(24)28(35)30-16-26(33)36-3/h4-9,12-15,18H,10-11,16-17H2,1-3H3,(H,30,35)(H,31,34)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 49n/an/an/an/a7.430



ALLERGAN, INC.

US Patent


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


US Patent US9388176 (2016)


BindingDB Entry DOI: 10.7270/Q2TQ60DZ
More data for this
Ligand-Target Pair