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SMILES: CCC(=O)N[C@H]1CC[C@@H](CC1)n1c2cc(Nc3ccc(N4CCN(C)CC4)c(C)c3)ccc2cc(-c2ccccc2Cl)c1=O

InChI Key:

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50599335   
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
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50599335
PNG
(CHEMBL5194245)
Show SMILES CCC(=O)N[C@H]1CC[C@@H](CC1)n1c2cc(Nc3ccc(N4CCN(C)CC4)c(C)c3)ccc2cc(-c2ccccc2Cl)c1=O |r,wU:5.4,wD:8.11,(4,-6.54,;2.66,-5.77,;2.66,-4.23,;4,-3.46,;1.33,-3.46,;1.33,-1.92,;-0,-1.15,;-0,.39,;1.33,1.16,;2.66,.39,;2.66,-1.15,;1.33,2.7,;-0,3.47,;-1.33,2.7,;-2.67,3.46,;-4,2.69,;-4,1.15,;-2.67,.38,;-2.67,-1.15,;-4,-1.92,;-4,-3.46,;-2.67,-4.24,;-2.67,-5.77,;-4,-6.55,;-4,-8.09,;-5.34,-5.78,;-5.34,-4.24,;-5.33,-1.16,;-6.66,-1.93,;-5.34,.38,;-2.67,5.01,;-1.33,5.78,;-0,5.01,;1.33,5.78,;2.66,5.01,;4,5.78,;4,7.32,;5.33,8.09,;6.66,7.31,;6.66,5.78,;5.34,5.01,;5.34,3.46,;2.66,3.47,;4,2.7,)|
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 38n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00876
BindingDB Entry DOI: 10.7270/Q2QF8XXX
More data for this
Ligand-Target Pair