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SMILES: Fc1cc2[C@H]3CCCN3c3ccn4ncc(CC(=O)NCCCCn(c1)c2=O)c4n3

InChI Key: InChIKey=FJFHXTKNFJCMHC-QGZVFWFLSA-N

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 2 hits for monomerid = 337640   
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
High affinity nerve growth factor receptor


(Homo sapiens (Human))
BDBM337640
PNG
(US9750744, Example 11)
Show SMILES Fc1cc2[C@H]3CCCN3c3ccn4ncc(CC(=O)NCCCCn(c1)c2=O)c4n3 |r|
Show InChI InChI=1S/C21H23FN6O2/c22-15-11-16-17-4-3-8-27(17)18-5-9-28-20(25-18)14(12-24-28)10-19(29)23-6-1-2-7-26(13-15)21(16)30/h5,9,11-13,17H,1-4,6-8,10H2,(H,23,29)/t17-/m1/s1
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Array BioPharma, Inc.

US Patent


Assay Description
The ability of a compound to bind to TrkA was measured by Invitrogen's LanthaScreen Eu Kinase Binding Assay. In this assay, His-tagged recombinan...


US Patent US9750744 (2017)


BindingDB Entry DOI: 10.7270/Q2C82CFX
More data for this
Ligand-Target Pair
High affinity nerve growth factor receptor


(Homo sapiens (Human))
BDBM337640
PNG
(US9750744, Example 11)
Show SMILES Fc1cc2[C@H]3CCCN3c3ccn4ncc(CC(=O)NCCCCn(c1)c2=O)c4n3 |r|
Show InChI InChI=1S/C21H23FN6O2/c22-15-11-16-17-4-3-8-27(17)18-5-9-28-20(25-18)14(12-24-28)10-19(29)23-6-1-2-7-26(13-15)21(16)30/h5,9,11-13,17H,1-4,6-8,10H2,(H,23,29)/t17-/m1/s1
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Array BioPharma, Inc.

US Patent


Assay Description
An enzyme-linked immunosorbant assay (ELISA) was used to assess TrkA kinase activity in the presence of inhibitors. Immulon 4HBX 384-well microtiter ...


US Patent US9750744 (2017)


BindingDB Entry DOI: 10.7270/Q2C82CFX
More data for this
Ligand-Target Pair