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SMILES: COc1cc(cc(OC)c1Br)-c1nn2C(CCNc2c1C(N)=O)C1CCN(CC1)C(=O)C=C

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 4 hits for monomerid = 50613204   
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
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM50613204
PNG
(CHEMBL5286702)
Show SMILES COc1cc(cc(OC)c1Br)-c1nn2C(CCNc2c1C(N)=O)C1CCN(CC1)C(=O)C=C
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 1.10n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM50613204
PNG
(CHEMBL5286702)
Show SMILES COc1cc(cc(OC)c1Br)-c1nn2C(CCNc2c1C(N)=O)C1CCN(CC1)C(=O)C=C
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 34n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Tec


(Homo sapiens (Human))
BDBM50613204
PNG
(CHEMBL5286702)
Show SMILES COc1cc(cc(OC)c1Br)-c1nn2C(CCNc2c1C(N)=O)C1CCN(CC1)C(=O)C=C
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 359n/an/an/an/an/an/a


TBA



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


(Homo sapiens (Human))
BDBM50613204
PNG
(CHEMBL5286702)
Show SMILES COc1cc(cc(OC)c1Br)-c1nn2C(CCNc2c1C(N)=O)C1CCN(CC1)C(=O)C=C
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 2.00E+3n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair