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BDBM50117381 4-{6-Methoxy-7-[3-(2-methyl-propane-1-sulfonyl)-propoxy]-quinazolin-4-yl}-piperazine-1-carboxylic acid (4-isopropoxy-phenyl)-amide::CHEMBL59735

SMILES: COc1cc2c(ncnc2cc1OCCCS(=O)(=O)CC(C)C)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1

InChI Key: InChIKey=KYKHCOJWGFWADS-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50117381   
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
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50117381
PNG
(4-{6-Methoxy-7-[3-(2-methyl-propane-1-sulfonyl)-pr...)
Show SMILES COc1cc2c(ncnc2cc1OCCCS(=O)(=O)CC(C)C)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
Show InChI InChI=1S/C30H41N5O6S/c1-21(2)19-42(37,38)16-6-15-40-28-18-26-25(17-27(28)39-5)29(32-20-31-26)34-11-13-35(14-12-34)30(36)33-23-7-9-24(10-8-23)41-22(3)4/h7-10,17-18,20-22H,6,11-16,19H2,1-5H3,(H,33,36)
PDB
MMDB

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UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 121n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of platelet derived growth factor receptor beta phosphorylation in MG63 cells in the presence of human plasma


J Med Chem 45: 3772-93 (2002)


BindingDB Entry DOI: 10.7270/Q2WW7JD9
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50117381
PNG
(4-{6-Methoxy-7-[3-(2-methyl-propane-1-sulfonyl)-pr...)
Show SMILES COc1cc2c(ncnc2cc1OCCCS(=O)(=O)CC(C)C)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
Show InChI InChI=1S/C30H41N5O6S/c1-21(2)19-42(37,38)16-6-15-40-28-18-26-25(17-27(28)39-5)29(32-20-31-26)34-11-13-35(14-12-34)30(36)33-23-7-9-24(10-8-23)41-22(3)4/h7-10,17-18,20-22H,6,11-16,19H2,1-5H3,(H,33,36)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents


Similars

PubMed
n/an/a 36n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of platelet-derived growth factor receptor beta phosphorylation in MG63 cells in the absence of plasma


J Med Chem 45: 3772-93 (2002)


BindingDB Entry DOI: 10.7270/Q2WW7JD9
More data for this
Ligand-Target Pair