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SMILES: COc1cc(N2CCC(CC2)N2CCN(C)CC2)c(C)cc1Nc1ncc(C)c(Nc2ccc(C)cc2P(C)(C)=O)n1

InChI Key:

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 5 hits for monomerid = 625604   
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 [1-18,20-1210,T790M]


(Homo sapiens (Human))
BDBM625604
PNG
(US20230322822, Compound 4)
Show SMILES COc1cc(N2CCC(CC2)N2CCN(C)CC2)c(C)cc1Nc1ncc(C)c(Nc2ccc(C)cc2P(C)(C)=O)n1
PDB
MMDB

Reactome pathway

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 43.8n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Epidermal growth factor receptor [1-18,20-1210,C797S]


(Homo sapiens (Human))
BDBM625604
PNG
(US20230322822, Compound 4)
Show SMILES COc1cc(N2CCC(CC2)N2CCN(C)CC2)c(C)cc1Nc1ncc(C)c(Nc2ccc(C)cc2P(C)(C)=O)n1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 80.6n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM625604
PNG
(US20230322822, Compound 4)
Show SMILES COc1cc(N2CCC(CC2)N2CCN(C)CC2)c(C)cc1Nc1ncc(C)c(Nc2ccc(C)cc2P(C)(C)=O)n1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 815n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
egfr-c797s/ t790m/del19


(Homo sapiens (Human))
BDBM625604
PNG
(US20230322822, Compound 4)
Show SMILES COc1cc(N2CCC(CC2)N2CCN(C)CC2)c(C)cc1Nc1ncc(C)c(Nc2ccc(C)cc2P(C)(C)=O)n1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 50.5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Epidermal growth factor receptor [L858R,T790M,C797S]


(Homo sapiens (Human))
BDBM625604
PNG
(US20230322822, Compound 4)
Show SMILES COc1cc(N2CCC(CC2)N2CCN(C)CC2)c(C)cc1Nc1ncc(C)c(Nc2ccc(C)cc2P(C)(C)=O)n1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 204n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair