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BDBM364467 US9862707, Example 41

SMILES: Cn1ccc(n1)-c1cc(C(=O)Nc2n(nc3cc(cnc23)C(C)(C)O)-c2ccccc2)c(F)cc1C(F)(F)F

InChI Key: InChIKey=HTXYHBDVEBYXEI-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 364467   
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))
BDBM364467
PNG
(US9862707, Example 41)
Show SMILES Cn1ccc(n1)-c1cc(C(=O)Nc2n(nc3cc(cnc23)C(C)(C)O)-c2ccccc2)c(F)cc1C(F)(F)F
Show InChI InChI=1S/C27H22F4N6O2/c1-26(2,39)15-11-22-23(32-14-15)24(37(35-22)16-7-5-4-6-8-16)33-25(38)18-12-17(21-9-10-36(3)34-21)19(13-20(18)28)27(29,30)31/h4-14,39H,1-3H3,(H,33,38)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 0.160n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of recombinant full length human TRKA expressed in U2OS cells using Poly(Glu:Tyr) as substrate after 30 mins by scintillation counting ass...


Eur J Med Chem 175: 129-148 (2019)


Article DOI: 10.1016/j.ejmech.2019.04.053
More data for this
Ligand-Target Pair
High affinity nerve growth factor receptor


(Homo sapiens (Human))
BDBM364467
PNG
(US9862707, Example 41)
Show SMILES Cn1ccc(n1)-c1cc(C(=O)Nc2n(nc3cc(cnc23)C(C)(C)O)-c2ccccc2)c(F)cc1C(F)(F)F
Show InChI InChI=1S/C27H22F4N6O2/c1-26(2,39)15-11-22-23(32-14-15)24(37(35-22)16-7-5-4-6-8-16)33-25(38)18-12-17(21-9-10-36(3)34-21)19(13-20(18)28)27(29,30)31/h4-14,39H,1-3H3,(H,33,38)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 0.160n/an/an/an/an/an/a



Rheinische Friedrich-Wilhelms-Universitat Bonn



Assay Description
TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...


J Med Chem 48: 7688-707 (2005)


BindingDB Entry DOI: 10.7270/Q2FB5576
More data for this
Ligand-Target Pair