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BDBM364482 (R or S)-N-[6-(2,2-difluoro-1- hydroxyethyl)-2-phenyl-2H- indazol-3-yl]-2-fluoro-5-pyrimidin- 2-yl-4-(trifluoromethyl)benzamide, isomer A::US9862707, Example 56::US9862707, Example 57

SMILES: OC(C(F)F)c1ccc2c(NC(=O)c3cc(-c4ncccn4)c(cc3F)C(F)(F)F)n(nc2c1)-c1ccccc1

InChI Key: InChIKey=KGAQXHWMFVCAJX-UHFFFAOYSA-N

Data: 2 IC50

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 = 364482   
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))
BDBM364482
PNG
((R or S)-N-[6-(2,2-difluoro-1- hydroxyethyl)-2-phe...)
Show SMILES OC(C(F)F)c1ccc2c(NC(=O)c3cc(-c4ncccn4)c(cc3F)C(F)(F)F)n(nc2c1)-c1ccccc1
Show InChI InChI=1S/C27H17F6N5O2/c28-20-13-19(27(31,32)33)17(24-34-9-4-10-35-24)12-18(20)26(40)36-25-16-8-7-14(22(39)23(29)30)11-21(16)37-38(25)15-5-2-1-3-6-15/h1-13,22-23,39H,(H,36,40)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 13n/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
High affinity nerve growth factor receptor


(Homo sapiens (Human))
BDBM364482
PNG
((R or S)-N-[6-(2,2-difluoro-1- hydroxyethyl)-2-phe...)
Show SMILES OC(C(F)F)c1ccc2c(NC(=O)c3cc(-c4ncccn4)c(cc3F)C(F)(F)F)n(nc2c1)-c1ccccc1
Show InChI InChI=1S/C27H17F6N5O2/c28-20-13-19(27(31,32)33)17(24-34-9-4-10-35-24)12-18(20)26(40)36-25-16-8-7-14(22(39)23(29)30)11-21(16)37-38(25)15-5-2-1-3-6-15/h1-13,22-23,39H,(H,36,40)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 2.80n/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