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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Epidermal growth factor receptor' and Ligand = 'BDBM270599'   
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
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM270599
PNG
((S)-N6-((1-(1-(tert- butyl)piperidin-4- yl)-1H-1,2...)
Show SMILES CC(C)(C)N1CCC(CC1)n1cc(nn1)[C@@H](Nc1ccc2ncnc(Nc3ccc(F)c(Cl)c3)c2c1)c1ccc(Cl)cc1 |r|
Show InChI InChI=1S/C32H33Cl2FN8/c1-32(2,3)42-14-12-24(13-15-42)43-18-29(40-41-43)30(20-4-6-21(33)7-5-20)38-22-9-11-28-25(16-22)31(37-19-36-28)39-23-8-10-27(35)26(34)17-23/h4-11,16-19,24,30,38H,12-15H2,1-3H3,(H,36,37,39)/t30-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 72n/an/an/an/an/an/a



Gilead Sciences, Inc.

US Patent


Assay Description
EGFR activity was measured using KinEASE (Cisbio), a time-resolved fluorescence resonance energy transfer (TR-FRET) immunoassay. In this assay, EGFR-...


US Patent US10577352 (2020)


BindingDB Entry DOI: 10.7270/Q20P12D3
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM270599
PNG
((S)-N6-((1-(1-(tert- butyl)piperidin-4- yl)-1H-1,2...)
Show SMILES CC(C)(C)N1CCC(CC1)n1cc(nn1)[C@@H](Nc1ccc2ncnc(Nc3ccc(F)c(Cl)c3)c2c1)c1ccc(Cl)cc1 |r|
Show InChI InChI=1S/C32H33Cl2FN8/c1-32(2,3)42-14-12-24(13-15-42)43-18-29(40-41-43)30(20-4-6-21(33)7-5-20)38-22-9-11-28-25(16-22)31(37-19-36-28)39-23-8-10-27(35)26(34)17-23/h4-11,16-19,24,30,38H,12-15H2,1-3H3,(H,36,37,39)/t30-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 72n/an/an/an/a7.025



GILEAD SCIENCES, INC.

US Patent


Assay Description
EGFR activity was measured using KinEASE (Cisbio), a time-resolved fluorescence resonance energy transfer (TR-FRET) immunoassay. In this assay, EGFR-...


US Patent US10059695 (2018)


BindingDB Entry DOI: 10.7270/Q2FB54Z6
More data for this
Ligand-Target Pair