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BDBM50092240 5-[4-(3-Amino-phenoxy)-phenyl]-7-tert-butyl-7H-pyrrolo[2,3-d]pyrimidin-4-ylamine::CHEMBL433097

SMILES: CC(C)(C)n1cc(-c2ccc(Oc3cccc(N)c3)cc2)c2c(N)ncnc12

InChI Key: InChIKey=OSYIMIXLSSLOOL-UHFFFAOYSA-N

Data: 4 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50092240   
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))
BDBM50092240
PNG
(5-[4-(3-Amino-phenoxy)-phenyl]-7-tert-butyl-7H-pyr...)
Show SMILES CC(C)(C)n1cc(-c2ccc(Oc3cccc(N)c3)cc2)c2c(N)ncnc12
Show InChI InChI=1S/C22H23N5O/c1-22(2,3)27-12-18(19-20(24)25-13-26-21(19)27)14-7-9-16(10-8-14)28-17-6-4-5-15(23)11-17/h4-13H,23H2,1-3H3,(H2,24,25,26)
PDB
MMDB

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KEGG

UniProtKB/SwissProt

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PC cid
PC sid
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PubMed
n/an/a 400n/an/an/an/an/an/a



BASF Bioresearch Corporation

Curated by ChEMBL


Assay Description
Inhibitory activity against vascular endothelial growth factor receptor 2 (VEGFR2) at a concentration of 5 microM ATP.


Bioorg Med Chem Lett 10: 2171-4 (2001)


BindingDB Entry DOI: 10.7270/Q2DB813K
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Lck


(Homo sapiens (Human))
BDBM50092240
PNG
(5-[4-(3-Amino-phenoxy)-phenyl]-7-tert-butyl-7H-pyr...)
Show SMILES CC(C)(C)n1cc(-c2ccc(Oc3cccc(N)c3)cc2)c2c(N)ncnc12
Show InChI InChI=1S/C22H23N5O/c1-22(2,3)27-12-18(19-20(24)25-13-26-21(19)27)14-7-9-16(10-8-14)28-17-6-4-5-15(23)11-17/h4-13H,23H2,1-3H3,(H2,24,25,26)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 15n/an/an/an/an/an/a



BASF Bioresearch Corporation

Curated by ChEMBL


Assay Description
Inhibition of p56 Lck tyrosine kinase (catalytic domain)


Bioorg Med Chem Lett 10: 2171-4 (2001)


BindingDB Entry DOI: 10.7270/Q2DB813K
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Lck


(Homo sapiens (Human))
BDBM50092240
PNG
(5-[4-(3-Amino-phenoxy)-phenyl]-7-tert-butyl-7H-pyr...)
Show SMILES CC(C)(C)n1cc(-c2ccc(Oc3cccc(N)c3)cc2)c2c(N)ncnc12
Show InChI InChI=1S/C22H23N5O/c1-22(2,3)27-12-18(19-20(24)25-13-26-21(19)27)14-7-9-16(10-8-14)28-17-6-4-5-15(23)11-17/h4-13H,23H2,1-3H3,(H2,24,25,26)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a<3n/an/an/an/an/an/a



BASF Bioresearch Corporation

Curated by ChEMBL


Assay Description
Inhibition of p56 Lck tyrosine kinase (catalytic domain)


Bioorg Med Chem Lett 10: 2171-4 (2001)


BindingDB Entry DOI: 10.7270/Q2DB813K
More data for this
Ligand-Target Pair
Angiopoietin-1 receptor


(Homo sapiens (Human))
BDBM50092240
PNG
(5-[4-(3-Amino-phenoxy)-phenyl]-7-tert-butyl-7H-pyr...)
Show SMILES CC(C)(C)n1cc(-c2ccc(Oc3cccc(N)c3)cc2)c2c(N)ncnc12
Show InChI InChI=1S/C22H23N5O/c1-22(2,3)27-12-18(19-20(24)25-13-26-21(19)27)14-7-9-16(10-8-14)28-17-6-4-5-15(23)11-17/h4-13H,23H2,1-3H3,(H2,24,25,26)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

PubMed
n/an/a 1.50E+3n/an/an/an/an/an/a



BASF Bioresearch Corporation

Curated by ChEMBL


Assay Description
Inhibitory activity against tie-2 at a concentration of 5 microM ATP.


Bioorg Med Chem Lett 10: 2171-4 (2001)


BindingDB Entry DOI: 10.7270/Q2DB813K
More data for this
Ligand-Target Pair