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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Platelet-derived growth factor receptor beta' and Ligand = 'BDBM50152344'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/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))
BDBM50152344
PNG
(4-[6-Methoxy-7-(3-morpholin-4-yl-propoxy)-quinazol...)
Show SMILES COc1cc2c(ncnc2cc1OCCCN1CCOCC1)N1CCN(CC1)C(=S)NCc1ccc(nc1)C(F)(F)F
Show InChI InChI=1S/C28H34F3N7O3S/c1-39-23-15-21-22(16-24(23)41-12-2-5-36-10-13-40-14-11-36)34-19-35-26(21)37-6-8-38(9-7-37)27(42)33-18-20-3-4-25(32-17-20)28(29,30)31/h3-4,15-17,19H,2,5-14,18H2,1H3,(H,33,42)
PDB
MMDB

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Article
PubMed
n/an/a 5n/an/an/an/an/an/a



and In Vivo Sciences Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibition of Platelet derived growth factor receptor beta autophosphorylation in MG-63 cells without plasma


Bioorg Med Chem Lett 14: 4867-72 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.041
BindingDB Entry DOI: 10.7270/Q2VM4BQN
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50152344
PNG
(4-[6-Methoxy-7-(3-morpholin-4-yl-propoxy)-quinazol...)
Show SMILES COc1cc2c(ncnc2cc1OCCCN1CCOCC1)N1CCN(CC1)C(=S)NCc1ccc(nc1)C(F)(F)F
Show InChI InChI=1S/C28H34F3N7O3S/c1-39-23-15-21-22(16-24(23)41-12-2-5-36-10-13-40-14-11-36)34-19-35-26(21)37-6-8-38(9-7-37)27(42)33-18-20-3-4-25(32-17-20)28(29,30)31/h3-4,15-17,19H,2,5-14,18H2,1H3,(H,33,42)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents


Similars

Article
PubMed
n/an/a 50n/an/an/an/an/an/a



and In Vivo Sciences Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibition of Platelet derived growth factor receptor beta autophosphorylation in MG-63 cells with 45% human plasma


Bioorg Med Chem Lett 14: 4867-72 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.041
BindingDB Entry DOI: 10.7270/Q2VM4BQN
More data for this
Ligand-Target Pair