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BDBM50543572 CHEMBL4641639

SMILES: COC(=O)c1ccc2\C(=C(\Nc3ccc(c(C)c3)-n3cccc3CN3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1

InChI Key: InChIKey=HDMDHLQOFWCVOU-MVJHLKBCSA-N

Data: 2 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 2 hits for monomerid = 50543572   
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
VHL/PDGFRB


(Homo sapiens (Human))
BDBM50543572
PNG
(CHEMBL4641639)
Show SMILES COC(=O)c1ccc2\C(=C(\Nc3ccc(c(C)c3)-n3cccc3CN3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1
Show InChI InChI=1S/C34H35N5O3/c1-23-20-26(12-14-30(23)39-15-7-10-27(39)22-38-18-16-37(2)17-19-38)35-32(24-8-5-4-6-9-24)31-28-13-11-25(34(41)42-3)21-29(28)36-33(31)40/h4-15,20-21,35H,16-19,22H2,1-3H3,(H,36,40)/b32-31-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PubMed
n/an/a 206n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of N-terminal GST-fused human PDGFRbeta cytoplasmic domain (557 to 1106 (end) residues) expressed in baculovirus expression system using F...


Bioorg Med Chem 28: (2020)

More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50543572
PNG
(CHEMBL4641639)
Show SMILES COC(=O)c1ccc2\C(=C(\Nc3ccc(c(C)c3)-n3cccc3CN3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1
Show InChI InChI=1S/C34H35N5O3/c1-23-20-26(12-14-30(23)39-15-7-10-27(39)22-38-18-16-37(2)17-19-38)35-32(24-8-5-4-6-9-24)31-28-13-11-25(34(41)42-3)21-29(28)36-33(31)40/h4-15,20-21,35H,16-19,22H2,1-3H3,(H,36,40)/b32-31-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PubMed
n/an/a 248n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of N-terminal GST fused human VEGFR2 cytoplasmic domain (790 to 1356 (end) residues) expressed in baculovirus expression system using FAM-...


Bioorg Med Chem 28: (2020)

More data for this
Ligand-Target Pair