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Target
Sequence
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Ki
IC50
Kd
EC50
Rate constants
ΔG°
ΔH°
-TΔS°
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Ki
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null
SMILES:
CCN(c1ccc(OC)cc1)c1nc(C)nc2oc(C)cc12
InChI Key:
InChIKey=HFGGBALVQWJPIV-UHFFFAOYSA-N
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
3
hits for monomerid = 50022522
Target/Host
(Institution)
Ligand
Target/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
k
off
s
-1
k
on
M
-1
s
-1
pH
Temp
°C
Vascular endothelial growth factor receptor 2
(Homo sapiens (Human))
BDBM50022522
(CHEMBL3297899)
Show SMILES
CCN(c1ccc(OC)cc1)c1nc(C)nc2oc(C)cc12
Show InChI
InChI=1S/C17H19N3O2/c1-5-20(13-6-8-14(21-4)9-7-13)16-15-10-11(2)22-17(15)19-12(3)18-16/h6-10H,5H2,1-4H3
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/a
n/a
11
n/a
n/a
n/a
n/a
n/a
n/a
Duquesne University
Curated by
ChEMBL
Assay Description
Inhibition of VEGFR2 in human U251 cells by phosphotyrosine ELISA assay
Bioorg Med Chem
22:
3753
-
72
(2014)
Article DOI:
10.1016/j.bmc.2014.04.049
BindingDB Entry DOI:
10.7270/Q20K2B45
More data for this
Ligand-Target Pair
Epidermal growth factor receptor
(Homo sapiens (Human))
BDBM50022522
(CHEMBL3297899)
Show SMILES
CCN(c1ccc(OC)cc1)c1nc(C)nc2oc(C)cc12
Show InChI
InChI=1S/C17H19N3O2/c1-5-20(13-6-8-14(21-4)9-7-13)16-15-10-11(2)22-17(15)19-12(3)18-16/h6-10H,5H2,1-4H3
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
CHEMBL
PC cid
PC sid
UniChem
Similars
Article
PubMed
n/a
n/a
71
n/a
n/a
n/a
n/a
n/a
n/a
Duquesne University
Curated by
ChEMBL
Assay Description
Inhibition of EGFR in human A431 cells by phosphotyrosine ELISA assay
Bioorg Med Chem
22:
3753
-
72
(2014)
Article DOI:
10.1016/j.bmc.2014.04.049
BindingDB Entry DOI:
10.7270/Q20K2B45
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta
(Homo sapiens (Human))
BDBM50022522
(CHEMBL3297899)
Show SMILES
CCN(c1ccc(OC)cc1)c1nc(C)nc2oc(C)cc12
Show InChI
InChI=1S/C17H19N3O2/c1-5-20(13-6-8-14(21-4)9-7-13)16-15-10-11(2)22-17(15)19-12(3)18-16/h6-10H,5H2,1-4H3
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/a
n/a
27
n/a
n/a
n/a
n/a
n/a
n/a
Duquesne University
Curated by
ChEMBL
Assay Description
Inhibition of PDGFRbeta in human SH-SY5Y cells by phosphotyrosine ELISA assay
Bioorg Med Chem
22:
3753
-
72
(2014)
Article DOI:
10.1016/j.bmc.2014.04.049
BindingDB Entry DOI:
10.7270/Q20K2B45
More data for this
Ligand-Target Pair
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