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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Epidermal growth factor receptor [T790M,L858R]' and Ligand = 'BDBM380794'   
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 [T790M,L858R]


(Homo sapiens (Human))		BDBM380794
PNG
(N-(5-(5-chloro-4-(1-methyl-1H-pyrazol-4-yl)-7H-pyr...)
Show SMILES COc1cc(N2CCN(C)CC2)c(NC(=O)C=C)cc1Nc1nc(-c2cnn(C)c2)c2c(Cl)c[nH]c2n1
Show InChI InChI=1S/C25H28ClN9O2/c1-5-21(36)29-17-10-18(20(37-4)11-19(17)35-8-6-33(2)7-9-35)30-25-31-23(15-12-28-34(3)14-15)22-16(26)13-27-24(22)32-25/h5,10-14H,1,6-9H2,2-4H3,(H,29,36)(H2,27,30,31,32)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
n/an/a 51n/an/an/an/an/an/a



Bryn Mawr College



Assay Description
The inhibitory activities on T790M/L858R double mutant EGFR kinase (Invitrogen, PV4879) and wild-type EGFR kinase (Invitrogen, PV3872) were determine...

J Med Chem 51: 1706-18 (2008)


BindingDB Entry DOI: 10.7270/Q2PV6NPJ
More data for this
Ligand-Target Pair