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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 349.3
BDBM50565286

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 3 hits in this display   
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
BDNF/NT-3 growth factors receptor


(Homo sapiens (Human))
BDBM50565286
PNG
(CHEMBL4778721)
Show SMILES Fc1cc(F)cc(Oc2ccc3[nH]nc(\C=C\c4ccccn4)c3c2)c1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of TrkB (unknown origin) using Tyr1 peptide as substrate in presence of ATP measured after 2 hrs by FRET-based Z-Lyte kinase assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112552
BindingDB Entry DOI: 10.7270/Q2W95DXR
More data for this
Ligand-Target Pair
NT-3 growth factor receptor


(Homo sapiens (Human))
BDBM50565286
PNG
(CHEMBL4778721)
Show SMILES Fc1cc(F)cc(Oc2ccc3[nH]nc(\C=C\c4ccccn4)c3c2)c1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 7.80n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of TrkC (unknown origin) using Tyr1 peptide as substrate in presence of ATP measured after 2 hrs by FRET-based Z-Lyte kinase assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112552
BindingDB Entry DOI: 10.7270/Q2W95DXR
More data for this
Ligand-Target Pair
High affinity nerve growth factor receptor


(Homo sapiens (Human))
BDBM50565286
PNG
(CHEMBL4778721)
Show SMILES Fc1cc(F)cc(Oc2ccc3[nH]nc(\C=C\c4ccccn4)c3c2)c1
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 23n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of TrkA (unknown origin) using Tyr1 peptide as substrate in presence of ATP measured after 2 hrs by FRET-based Z-Lyte kinase assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112552
BindingDB Entry DOI: 10.7270/Q2W95DXR
More data for this
Ligand-Target Pair