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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Platelet-derived growth factor receptor beta' and Ligand = 'BDBM50152352'   
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))
BDBM50152352
PNG
(4-[6-Methoxy-7-(3-piperidin-1-yl-propoxy)-quinazol...)
Show SMILES COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=S)NCc1ccc(C)o1
Show InChI InChI=1S/C28H38N6O3S/c1-21-7-8-22(37-21)19-29-28(38)34-14-12-33(13-15-34)27-23-17-25(35-2)26(18-24(23)30-20-31-27)36-16-6-11-32-9-4-3-5-10-32/h7-8,17-18,20H,3-6,9-16,19H2,1-2H3,(H,29,38)
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Article
PubMed
n/an/a 80n/an/an/an/an/an/a



and In Vivo Sciences Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Platelet derived growth factor receptor beta autophosphorylation in CHO cells


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))
BDBM50152352
PNG
(4-[6-Methoxy-7-(3-piperidin-1-yl-propoxy)-quinazol...)
Show SMILES COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=S)NCc1ccc(C)o1
Show InChI InChI=1S/C28H38N6O3S/c1-21-7-8-22(37-21)19-29-28(38)34-14-12-33(13-15-34)27-23-17-25(35-2)26(18-24(23)30-20-31-27)36-16-6-11-32-9-4-3-5-10-32/h7-8,17-18,20H,3-6,9-16,19H2,1-2H3,(H,29,38)
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KEGG

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antibodypedia
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 80n/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))
BDBM50152352
PNG
(4-[6-Methoxy-7-(3-piperidin-1-yl-propoxy)-quinazol...)
Show SMILES COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=S)NCc1ccc(C)o1
Show InChI InChI=1S/C28H38N6O3S/c1-21-7-8-22(37-21)19-29-28(38)34-14-12-33(13-15-34)27-23-17-25(35-2)26(18-24(23)30-20-31-27)36-16-6-11-32-9-4-3-5-10-32/h7-8,17-18,20H,3-6,9-16,19H2,1-2H3,(H,29,38)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 90n/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