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BDBM395303 N-{6-(2-Hydroxypropan-2-yl)-2-[3-(2,2,2-trifluoroethoxy)propyl]-2H-indazol-5-yl}-6-(trifluoromethyl)pyridine-2-carboxamide::US10308634, Example 18::US10793545, Example 18

SMILES: CC(C)(O)c1cc2nn(CCCOCC(F)(F)F)cc2cc1NC(=O)c1cccc(n1)C(F)(F)F

InChI Key: InChIKey=ANRGZJLZBFJJTI-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 = 395303   
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
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM395303
PNG
(N-{6-(2-Hydroxypropan-2-yl)-2-[3-(2,2,2-trifluoroe...)
Show SMILES CC(C)(O)c1cc2nn(CCCOCC(F)(F)F)cc2cc1NC(=O)c1cccc(n1)C(F)(F)F
Show InChI InChI=1S/C22H22F6N4O3/c1-20(2,34)14-10-16-13(11-32(31-16)7-4-8-35-12-21(23,24)25)9-17(14)30-19(33)15-5-3-6-18(29-15)22(26,27)28/h3,5-6,9-11,34H,4,7-8,12H2,1-2H3,(H,30,33)
PDB
MMDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 47.5n/an/an/an/an/an/a



Bayer Pharma Aktiengesellschaft

US Patent


Assay Description
For the assay, 11 different concentrations in the range from 20 μM to 0.073 nM were prepared from a 2 mM DMSO solution of the test substance. 50...


US Patent US10793545 (2020)

More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM395303
PNG
(N-{6-(2-Hydroxypropan-2-yl)-2-[3-(2,2,2-trifluoroe...)
Show SMILES CC(C)(O)c1cc2nn(CCCOCC(F)(F)F)cc2cc1NC(=O)c1cccc(n1)C(F)(F)F
Show InChI InChI=1S/C22H22F6N4O3/c1-20(2,34)14-10-16-13(11-32(31-16)7-4-8-35-12-21(23,24)25)9-17(14)30-19(33)15-5-3-6-18(29-15)22(26,27)28/h3,5-6,9-11,34H,4,7-8,12H2,1-2H3,(H,30,33)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 47.5n/an/an/an/an/an/a



Amgen



Assay Description
For the assay, 11 different concentrations in the range from 20 μM to 0.073 nM were prepared from a 2 mM DMSO solution of the test substance. 50...


Bioorg Med Chem Lett 19: 3550-4 (2009)


BindingDB Entry DOI: 10.7270/Q2J67K7G
More data for this
Ligand-Target Pair